N-(3-bromophenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-bromophenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(3-bromophenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide CAS Name: N-(3-bromophenyl)-4-(4-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-bromophenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(3-bromophenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide Formula: C18H20BrN3OS MolecularWeight: 406.3399

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H20BrN3OS/c1-23-17-7-5-16(6-8-17)21-9-11-22(12-10-21)18(24)20-15-4-2-3-14(19)13-15/h2-8,13H,9-12H2,1H3,(H,20,24)