2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-(3-chloranyl-4-methyl-phenyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-(3-chloranyl-4-methyl-phenyl)ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-(3-chloro-4-methyl-phenyl)acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-N-(3-chloro-4-methylphenyl)acetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-(3-chloro-4-methylphenyl)acetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-N-(3-chloro-4-methyl-phenyl)acetamide Formula: C21H23ClN4OS MolecularWeight: 414.95152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H23ClN4OS/c1-15-6-7-16(12-17(15)22)23-20(27)13-25-8-10-26(11-9-25)14-21-24-18-4-2-3-5-19(18)28-21/h2-7,12H,8-11,13-14H2,1H3,(H,23,27)