N-[[[4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[[4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[[[4-(4-ethoxyanilino)-4-oxo-butanoyl]amino]carbamothioyl]-3-methyl-butanamide CAS Name: N-[[[4-(4-ethoxyanilino)-1,4-dioxobutyl]hydrazo]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[[4-(4-ethoxyanilino)-4-oxobutanoyl]amino]carbamothioyl]-3-methylbutanamide Traditional Name: N-[[[4-keto-4-(p-phenetidino)butanoyl]amino]thiocarbamoyl]-3-methyl-butyramide Formula: C18H26N4O4S MolecularWeight: 394.48844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)CC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)CC(C)C

InChI

InChI=1S/C18H26N4O4S/c1-4-26-14-7-5-13(6-8-14)19-15(23)9-10-16(24)21-22-18(27)20-17(25)11-12(2)3/h5-8,12H,4,9-11H2,1-3H3,(H,19,23)(H,21,24)(H2,20,22,25,27)