N-[[[4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]cyclopropanecarboxamide

Systemtic Name: N-[[[4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]cyclopropanecarboxamide Openeye Name: N-[[[4-(4-ethoxyanilino)-4-oxo-butanoyl]amino]carbamothioyl]cyclopropanecarboxamide CAS Name: N-[[[4-(4-ethoxyanilino)-1,4-dioxobutyl]hydrazo]-sulfanylidenemethyl]cyclopropanecarboxamide IUPAC Name: N-[[[4-(4-ethoxyanilino)-4-oxobutanoyl]amino]carbamothioyl]cyclopropanecarboxamide Traditional Name: N-[[[4-keto-4-(p-phenetidino)butanoyl]amino]thiocarbamoyl]cyclopropanecarboxamide Formula: C17H22N4O4S MolecularWeight: 378.44598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)C2CC2

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)C2CC2

InChI

InChI=1S/C17H22N4O4S/c1-2-25-13-7-5-12(6-8-13)18-14(22)9-10-15(23)20-21-17(26)19-16(24)11-3-4-11/h5-8,11H,2-4,9-10H2,1H3,(H,18,22)(H,20,23)(H2,19,21,24,26)