N-[4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonylphenyl]-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonylphenyl]-1,2-benzothiazole-3-carboxamide Openeye Name: N-[4-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]phenyl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[4-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-oxomethyl]phenyl]-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]phenyl]-1,2-benzothiazole-3-carboxamide Traditional Name: N-[4-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]phenyl]-1,2-benzothiazole-3-carboxamide Formula: C26H23ClN4O2S MolecularWeight: 491.00442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)C4=NSC5=CC=CC=C54

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C26H23ClN4O2S/c1-17-6-9-19(27)16-22(17)30-12-14-31(15-13-30)26(33)18-7-10-20(11-8-18)28-25(32)24-21-4-2-3-5-23(21)34-29-24/h2-11,16H,12-15H2,1H3,(H,28,32)