N-(azepan-1-ylcarbothioyl)-3-bromanyl-4-(2-methoxyethoxy)benzamide

Systemtic Name: N-(azepan-1-ylcarbothioyl)-3-bromanyl-4-(2-methoxyethoxy)benzamide Openeye Name: N-(azepane-1-carbothioyl)-3-bromo-4-(2-methoxyethoxy)benzamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-3-bromo-4-(2-methoxyethoxy)benzamide IUPAC Name: N-(azepane-1-carbothioyl)-3-bromo-4-(2-methoxyethoxy)benzamide Traditional Name: N-(azepane-1-carbothioyl)-3-bromo-4-(2-methoxyethoxy)benzamide Formula: C17H23BrN2O3S MolecularWeight: 415.34512

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)N2CCCCCC2)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)N2CCCCCC2)Br

InChI

InChI=1S/C17H23BrN2O3S/c1-22-10-11-23-15-7-6-13(12-14(15)18)16(21)19-17(24)20-8-4-2-3-5-9-20/h6-7,12H,2-5,8-11H2,1H3,(H,19,21,24)