5-[(3-chlorophenyl)methyl]-2-[4-(4-methylphenyl)piperazin-1-yl]-1,3-thiazol-4-one

Systemtic Name: 5-[(3-chlorophenyl)methyl]-2-[4-(4-methylphenyl)piperazin-1-yl]-1,3-thiazol-4-one Openeye Name: 5-[(3-chlorophenyl)methyl]-2-[4-(p-tolyl)piperazin-1-yl]thiazol-4-one CAS Name: 5-[(3-chlorophenyl)methyl]-2-[4-(4-methylphenyl)-1-piperazinyl]-4-thiazolone IUPAC Name: 5-[(3-chlorophenyl)methyl]-2-[4-(4-methylphenyl)piperazin-1-yl]-1,3-thiazol-4-one Traditional Name: 5-(3-chlorobenzyl)-2-[4-(p-tolyl)piperazino]-2-thiazolin-4-one Formula: C21H22ClN3OS MolecularWeight: 399.93688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)C3=NC(=O)C(S3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)C3=NC(=O)C(S3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H22ClN3OS/c1-15-5-7-18(8-6-15)24-9-11-25(12-10-24)21-23-20(26)19(27-21)14-16-3-2-4-17(22)13-16/h2-8,13,19H,9-12,14H2,1H3