3-butoxy-N-[[3-(cyclopropylcarbonylamino)-2-methyl-phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[3-(cyclopropylcarbonylamino)-2-methyl-phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[3-(cyclopropanecarbonylamino)-2-methyl-phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[3-[[cyclopropyl(oxo)methyl]amino]-2-methylanilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[3-(cyclopropanecarbonylamino)-2-methylphenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[3-(cyclopropanecarbonylamino)-2-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=CC(=C2C)NC(=O)C3CC3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2C)NC(=O)C3CC3

InChI

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