methyl 2-[2-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]ethanoylamino]-3-thiophen-3-yl-propanoate

Systemtic Name: methyl 2-[2-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]ethanoylamino]-3-thiophen-3-yl-propanoate Openeye Name: methyl 2-[[2-[[3-(hydrazinomethyleneamino)benzoyl]amino]acetyl]amino]-3-(3-thienyl)propanoate CAS Name: 2-[[2-[[[3-(hydrazinylmethylideneamino)phenyl]-oxomethyl]amino]-1-oxoethyl]amino]-3-(3-thiophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[[2-[[3-(hydrazinylmethylideneamino)benzoyl]amino]acetyl]amino]-3-thiophen-3-ylpropanoate Traditional Name: 2-[[2-[[3-(hydrazinomethyleneamino)benzoyl]amino]acetyl]amino]-3-(3-thienyl)propionic acid methyl ester Formula: C18H21N5O4S MolecularWeight: 403.45544

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CSC=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)N=CNN

Isomeric SMILES

COC(=O)C(CC1=CSC=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)N=CNN

InChI

InChI=1S/C18H21N5O4S/c1-27-18(26)15(7-12-5-6-28-10-12)23-16(24)9-20-17(25)13-3-2-4-14(8-13)21-11-22-19/h2-6,8,10-11,15H,7,9,19H2,1H3,(H,20,25)(H,21,22)(H,23,24)