3-bromanyl-4-(3-methylbutoxy)-N-(4-methylpiperidin-1-yl)carbothioyl-benzamide

Systemtic Name: 3-bromanyl-4-(3-methylbutoxy)-N-(4-methylpiperidin-1-yl)carbothioyl-benzamide Openeye Name: 3-bromo-4-isopentyloxy-N-(4-methylpiperidine-1-carbothioyl)benzamide CAS Name: 3-bromo-4-(3-methylbutoxy)-N-[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(3-methylbutoxy)-N-(4-methylpiperidine-1-carbothioyl)benzamide Traditional Name: 3-bromo-4-isoamoxy-N-(4-methylpiperidine-1-carbothioyl)benzamide Formula: C19H27BrN2O2S MolecularWeight: 427.39888

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br

Isomeric SMILES

CC1CCN(CC1)C(=S)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br

InChI

InChI=1S/C19H27BrN2O2S/c1-13(2)8-11-24-17-5-4-15(12-16(17)20)18(23)21-19(25)22-9-6-14(3)7-10-22/h4-5,12-14H,6-11H2,1-3H3,(H,21,23,25)