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

Systemtic Name: 4-tert-butyl-N-[[3-(cyclopropylcarbonylamino)-4-methyl-phenyl]carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[[3-(cyclopropanecarbonylamino)-4-methyl-phenyl]carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[3-[[cyclopropyl(oxo)methyl]amino]-4-methylanilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[3-(cyclopropanecarbonylamino)-4-methylphenyl]carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[[3-(cyclopropanecarbonylamino)-4-methyl-phenyl]thiocarbamoyl]benzamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C)NC(=O)C3CC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C)NC(=O)C3CC3

InChI

InChI=1S/C23H27N3O2S/c1-14-5-12-18(13-19(14)25-20(27)15-6-7-15)24-22(29)26-21(28)16-8-10-17(11-9-16)23(2,3)4/h5,8-13,15H,6-7H2,1-4H3,(H,25,27)(H2,24,26,28,29)