N-[[[4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]-2-(3-methylbutoxy)benzamide

Systemtic Name: N-[[[4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]-2-(3-methylbutoxy)benzamide Openeye Name: N-[[[4-(4-ethoxyanilino)-4-oxo-butanoyl]amino]carbamothioyl]-2-isopentyloxy-benzamide CAS Name: N-[[[4-(4-ethoxyanilino)-1,4-dioxobutyl]hydrazo]-sulfanylidenemethyl]-2-(3-methylbutoxy)benzamide IUPAC Name: N-[[[4-(4-ethoxyanilino)-4-oxobutanoyl]amino]carbamothioyl]-2-(3-methylbutoxy)benzamide Traditional Name: 2-isoamoxy-N-[[[4-keto-4-(p-phenetidino)butanoyl]amino]thiocarbamoyl]benzamide Formula: C25H32N4O5S MolecularWeight: 500.61038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCC(C)C

InChI

InChI=1S/C25H32N4O5S/c1-4-33-19-11-9-18(10-12-19)26-22(30)13-14-23(31)28-29-25(35)27-24(32)20-7-5-6-8-21(20)34-16-15-17(2)3/h5-12,17H,4,13-16H2,1-3H3,(H,26,30)(H,28,31)(H2,27,29,32,35)