N-(4-bromophenyl)-N-[2-(dimethylamino)cycloheptyl]propanethioamide

Systemtic Name: N-(4-bromophenyl)-N-[2-(dimethylamino)cycloheptyl]propanethioamide Openeye Name: N-(4-bromophenyl)-N-[2-(dimethylamino)cycloheptyl]propanethioamide CAS Name: N-(4-bromophenyl)-N-[2-(dimethylamino)cycloheptyl]propanethioamide IUPAC Name: N-(4-bromophenyl)-N-[2-(dimethylamino)cycloheptyl]propanethioamide Traditional Name: N-(4-bromophenyl)-N-[2-(dimethylamino)cycloheptyl]thiopropionamide Formula: C18H27BrN2S MolecularWeight: 383.38938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=S)N(C1CCCCCC1N(C)C)C2=CC=C(C=C2)Br

Isomeric SMILES

CCC(=S)N(C1CCCCCC1N(C)C)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H27BrN2S/c1-4-18(22)21(15-12-10-14(19)11-13-15)17-9-7-5-6-8-16(17)20(2)3/h10-13,16-17H,4-9H2,1-3H3