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

Systemtic Name: 4-butoxy-N-[[3-(cyclopropylcarbonylamino)-4-methyl-phenyl]carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[[3-(cyclopropanecarbonylamino)-4-methyl-phenyl]carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[3-[[cyclopropyl(oxo)methyl]amino]-4-methylanilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[[3-(cyclopropanecarbonylamino)-4-methylphenyl]carbamothioyl]benzamide Traditional Name: 4-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=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)C)NC(=O)C3CC3

Isomeric SMILES

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

InChI

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