3-bromanyl-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-4-(3-methylbutoxy)benzamide

Systemtic Name: 3-bromanyl-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: 3-bromo-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-4-isopentyloxy-benzamide CAS Name: 3-bromo-N-[[3-[(cyclohexylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: 3-bromo-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: 3-bromo-N-[[3-(cyclohexylcarbamoyl)phenyl]thiocarbamoyl]-4-isoamoxy-benzamide Formula: C26H32BrN3O3S MolecularWeight: 546.51958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3)Br

InChI

InChI=1S/C26H32BrN3O3S/c1-17(2)13-14-33-23-12-11-19(16-22(23)27)25(32)30-26(34)29-21-10-6-7-18(15-21)24(31)28-20-8-4-3-5-9-20/h6-7,10-12,15-17,20H,3-5,8-9,13-14H2,1-2H3,(H,28,31)(H2,29,30,32,34)