3-butoxy-N-[[3-(cyclopropylcarbonylamino)-4-methyl-phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[3-(cyclopropylcarbonylamino)-4-methyl-phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[3-(cyclopropanecarbonylamino)-4-methyl-phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[3-[[cyclopropyl(oxo)methyl]amino]-4-methylanilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[3-(cyclopropanecarbonylamino)-4-methylphenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[3-(cyclopropanecarbonylamino)-4-methyl-phenyl]thiocarbamoyl]benzamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)C)NC(=O)C3CC3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)C)NC(=O)C3CC3

InChI

InChI=1S/C23H27N3O3S/c1-3-4-12-29-19-7-5-6-17(13-19)22(28)26-23(30)24-18-11-8-15(2)20(14-18)25-21(27)16-9-10-16/h5-8,11,13-14,16H,3-4,9-10,12H2,1-2H3,(H,25,27)(H2,24,26,28,30)