methyl 4-[[2-[(4-methoxyphenyl)amino]ethanoylamino]carbamothioylamino]butanoate

Systemtic Name: methyl 4-[[2-[(4-methoxyphenyl)amino]ethanoylamino]carbamothioylamino]butanoate Openeye Name: methyl 4-[[[2-(4-methoxyanilino)acetyl]amino]carbamothioylamino]butanoate CAS Name: 4-[[[[2-(4-methoxyanilino)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[[2-(4-methoxyanilino)acetyl]amino]carbamothioylamino]butanoate Traditional Name: 4-[[[2-(p-anisidino)acetyl]amino]thiocarbamoylamino]butyric acid methyl ester Formula: C15H22N4O4S MolecularWeight: 354.42458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NCC(=O)NNC(=S)NCCCC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)NCC(=O)NNC(=S)NCCCC(=O)OC

InChI

InChI=1S/C15H22N4O4S/c1-22-12-7-5-11(6-8-12)17-10-13(20)18-19-15(24)16-9-3-4-14(21)23-2/h5-8,17H,3-4,9-10H2,1-2H3,(H,18,20)(H2,16,19,24)