[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone

Systemtic Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Openeye Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(3-phenyl-2-thioxo-1H-imidazol-4-yl)methanone CAS Name: [4-[(3-chlorophenyl)methyl]-1-piperazinyl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone IUPAC Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Traditional Name: [4-(3-chlorobenzyl)piperazino]-(3-phenyl-2-thioxo-4-imidazolin-4-yl)methanone Formula: C21H21ClN4OS MolecularWeight: 412.93564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Cl)C(=O)C3=CNC(=S)N3C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Cl)C(=O)C3=CNC(=S)N3C4=CC=CC=C4

InChI

InChI=1S/C21H21ClN4OS/c22-17-6-4-5-16(13-17)15-24-9-11-25(12-10-24)20(27)19-14-23-21(28)26(19)18-7-2-1-3-8-18/h1-8,13-14H,9-12,15H2,(H,23,28)