3-bromanyl-4-(3-methylbutoxy)-N-piperidin-1-ylcarbothioyl-benzamide

Systemtic Name: 3-bromanyl-4-(3-methylbutoxy)-N-piperidin-1-ylcarbothioyl-benzamide Openeye Name: 3-bromo-4-isopentyloxy-N-(piperidine-1-carbothioyl)benzamide CAS Name: 3-bromo-4-(3-methylbutoxy)-N-[1-piperidinyl(sulfanylidene)methyl]benzamide IUPAC Name: 3-bromo-4-(3-methylbutoxy)-N-(piperidine-1-carbothioyl)benzamide Traditional Name: 3-bromo-4-isoamoxy-N-(piperidine-1-carbothioyl)benzamide Formula: C18H25BrN2O2S MolecularWeight: 413.3723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)N2CCCCC2)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)N2CCCCC2)Br

InChI

InChI=1S/C18H25BrN2O2S/c1-13(2)8-11-23-16-7-6-14(12-15(16)19)17(22)20-18(24)21-9-4-3-5-10-21/h6-7,12-13H,3-5,8-11H2,1-2H3,(H,20,22,24)