propyl 4-oxidanylidene-4-[[(4-oxidanylidene-4-phenylazanyl-butanoyl)amino]carbamothioylamino]butanoate

Systemtic Name: propyl 4-oxidanylidene-4-[[(4-oxidanylidene-4-phenylazanyl-butanoyl)amino]carbamothioylamino]butanoate Openeye Name: propyl 4-[[(4-anilino-4-oxo-butanoyl)amino]carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[[(4-anilino-1,4-dioxobutyl)hydrazo]-sulfanylidenemethyl]amino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-[[(4-anilino-4-oxobutanoyl)amino]carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[[(4-anilino-4-keto-butanoyl)amino]thiocarbamoylamino]-4-keto-butyric acid propyl ester Formula: C18H24N4O5S MolecularWeight: 408.47196

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)NNC(=O)CCC(=O)NC1=CC=CC=C1

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NNC(=O)CCC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C18H24N4O5S/c1-2-12-27-17(26)11-10-15(24)20-18(28)22-21-16(25)9-8-14(23)19-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H,19,23)(H,21,25)(H2,20,22,24,28)