3-bromanyl-N-[[2-[cyclohexyl(methyl)carbamoyl]phenyl]carbamothioyl]-4-phenethyloxy-benzamide

Systemtic Name: 3-bromanyl-N-[[2-[cyclohexyl(methyl)carbamoyl]phenyl]carbamothioyl]-4-phenethyloxy-benzamide Openeye Name: 3-bromo-N-[[2-[cyclohexyl(methyl)carbamoyl]phenyl]carbamothioyl]-4-phenethyloxy-benzamide CAS Name: 3-bromo-N-[[2-[[cyclohexyl(methyl)amino]-oxomethyl]anilino]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: 3-bromo-N-[[2-[cyclohexyl(methyl)carbamoyl]phenyl]carbamothioyl]-4-phenethyloxybenzamide Traditional Name: 3-bromo-N-[[2-[cyclohexyl(methyl)carbamoyl]phenyl]thiocarbamoyl]-4-phenethyloxy-benzamide Formula: C30H32BrN3O3S MolecularWeight: 594.56238

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=C(C=C3)OCCC4=CC=CC=C4)Br

Isomeric SMILES

CN(C1CCCCC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=C(C=C3)OCCC4=CC=CC=C4)Br

InChI

InChI=1S/C30H32BrN3O3S/c1-34(23-12-6-3-7-13-23)29(36)24-14-8-9-15-26(24)32-30(38)33-28(35)22-16-17-27(25(31)20-22)37-19-18-21-10-4-2-5-11-21/h2,4-5,8-11,14-17,20,23H,3,6-7,12-13,18-19H2,1H3,(H2,32,33,35,38)