[5-(3-bromophenyl)-3,4-dihydropyrazol-2-yl]-(4-phenylpiperazin-1-yl)methanethione

Systemtic Name: [5-(3-bromophenyl)-3,4-dihydropyrazol-2-yl]-(4-phenylpiperazin-1-yl)methanethione Openeye Name: [5-(3-bromophenyl)-3,4-dihydropyrazol-2-yl]-(4-phenylpiperazin-1-yl)methanethione CAS Name: [5-(3-bromophenyl)-3,4-dihydropyrazol-2-yl]-(4-phenyl-1-piperazinyl)methanethione IUPAC Name: [5-(3-bromophenyl)-3,4-dihydropyrazol-2-yl]-(4-phenylpiperazin-1-yl)methanethione Traditional Name: [3-(3-bromophenyl)-2-pyrazolin-1-yl]-(4-phenylpiperazino)methanethione Formula: C20H21BrN4S MolecularWeight: 429.37654

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC(=CC=C2)Br)C(=S)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CN(N=C1C2=CC(=CC=C2)Br)C(=S)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H21BrN4S/c21-17-6-4-5-16(15-17)19-9-10-25(22-19)20(26)24-13-11-23(12-14-24)18-7-2-1-3-8-18/h1-8,15H,9-14H2