PDB CCD ID: | 9ZG |
Number of entries in BioLiP: | 2 |
Chemical formula: | C20 H26 N4 O3 |
InChI: | InChI=1S/C20H26N4O3/c1-23(15-21)24(2)19(25)18(13-16-9-5-3-6-10-16)22-20(26)27-14-17-11-7-4-8-12-17/h3-12,18H,13-15,21H2,1-2H3,(H,22,26)/t18-/m0/s1 |
InChIKey: | OUWJIALCFGQZPQ-SFHVURJKSA-N |
SMILES: | Software | SMILES |
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CACTVS 3.385 | CN(CN)N(C)C(=O)[CH](Cc1ccccc1)NC(=O)OCc2ccccc2 | CACTVS 3.385 OpenEye OEToolkits 2.0.7 | CN(CN)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc2ccccc2 | OpenEye OEToolkits 2.0.7 | CN(CN)N(C)C(=O)C(Cc1ccccc1)NC(=O)OCc2ccccc2 |
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Name: | (phenylmethyl) ~{N}-[(2~{S})-1-[[aminomethyl(methyl)amino]-methyl-amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate |