3-bromanyl-N-[[3-(cyclopropylcarbonylamino)-4-methyl-phenyl]carbamothioyl]-4-propan-2-yloxy-benzamide

Systemtic Name: 3-bromanyl-N-[[3-(cyclopropylcarbonylamino)-4-methyl-phenyl]carbamothioyl]-4-propan-2-yloxy-benzamide Openeye Name: 3-bromo-N-[[3-(cyclopropanecarbonylamino)-4-methyl-phenyl]carbamothioyl]-4-isopropoxy-benzamide CAS Name: 3-bromo-N-[[3-[[cyclopropyl(oxo)methyl]amino]-4-methylanilino]-sulfanylidenemethyl]-4-propan-2-yloxybenzamide IUPAC Name: 3-bromo-N-[[3-(cyclopropanecarbonylamino)-4-methylphenyl]carbamothioyl]-4-propan-2-yloxybenzamide Traditional Name: 3-bromo-N-[[3-(cyclopropanecarbonylamino)-4-methyl-phenyl]thiocarbamoyl]-4-isopropoxy-benzamide Formula: C22H24BrN3O3S MolecularWeight: 490.41326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24BrN3O3S/c1-12(2)29-19-9-7-15(10-17(19)23)21(28)26-22(30)24-16-8-4-13(3)18(11-16)25-20(27)14-5-6-14/h4,7-12,14H,5-6H2,1-3H3,(H,25,27)(H2,24,26,28,30)