N-(4-bromanyl-3-methyl-phenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(1-phenylethyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide Formula: C20H24BrN3S MolecularWeight: 418.39366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)N2CCN(CC2)C(C)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)N2CCN(CC2)C(C)C3=CC=CC=C3)Br

InChI

InChI=1S/C20H24BrN3S/c1-15-14-18(8-9-19(15)21)22-20(25)24-12-10-23(11-13-24)16(2)17-6-4-3-5-7-17/h3-9,14,16H,10-13H2,1-2H3,(H,22,25)