N-[3-[4-(3-methoxyphenyl)piperazin-1-yl]carbonylphenyl]-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[3-[4-(3-methoxyphenyl)piperazin-1-yl]carbonylphenyl]-1,2-benzothiazole-3-carboxamide Openeye Name: N-[3-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phenyl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[3-[[4-(3-methoxyphenyl)-1-piperazinyl]-oxomethyl]phenyl]-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[3-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phenyl]-1,2-benzothiazole-3-carboxamide Traditional Name: N-[3-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phenyl]-1,2-benzothiazole-3-carboxamide Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)C4=NSC5=CC=CC=C54

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C26H24N4O3S/c1-33-21-9-5-8-20(17-21)29-12-14-30(15-13-29)26(32)18-6-4-7-19(16-18)27-25(31)24-22-10-2-3-11-23(22)34-28-24/h2-11,16-17H,12-15H2,1H3,(H,27,31)