N-(4-bromanyl-3-methyl-phenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-(4-bromo-3-methylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-(4-bromo-3-methylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C17H17BrN2S MolecularWeight: 361.29928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)N2CCC3=CC=CC=C3C2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)N2CCC3=CC=CC=C3C2)Br

InChI

InChI=1S/C17H17BrN2S/c1-12-10-15(6-7-16(12)18)19-17(21)20-9-8-13-4-2-3-5-14(13)11-20/h2-7,10H,8-9,11H2,1H3,(H,19,21)