N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-chloranyl-5-ethyl-2,6-dimethoxy-benzamide

Systemtic Name: N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-chloranyl-5-ethyl-2,6-dimethoxy-benzamide Openeye Name: N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-chloro-5-ethyl-2,6-dimethoxy-benzamide CAS Name: N-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-3-chloro-5-ethyl-2,6-dimethoxybenzamide IUPAC Name: N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-chloro-5-ethyl-2,6-dimethoxybenzamide Traditional Name: N-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butyl]-3-chloro-5-ethyl-2,6-dimethoxy-benzamide Formula: C26H33ClN4O3S MolecularWeight: 517.08322

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1OC)C(=O)NCCCCN2CCN(CC2)C3=NSC4=CC=CC=C43)OC)Cl

Isomeric SMILES

CCC1=CC(=C(C(=C1OC)C(=O)NCCCCN2CCN(CC2)C3=NSC4=CC=CC=C43)OC)Cl

InChI

InChI=1S/C26H33ClN4O3S/c1-4-18-17-20(27)24(34-3)22(23(18)33-2)26(32)28-11-7-8-12-30-13-15-31(16-14-30)25-19-9-5-6-10-21(19)35-29-25/h5-6,9-10,17H,4,7-8,11-16H2,1-3H3,(H,28,32)