2-[3-(1,3-benzothiazol-2-ylamino)propyl]-3-chloranyl-5,6-dimethoxy-4-piperidin-4-yl-benzamide

Systemtic Name: 2-[3-(1,3-benzothiazol-2-ylamino)propyl]-3-chloranyl-5,6-dimethoxy-4-piperidin-4-yl-benzamide Openeye Name: 2-[3-(1,3-benzothiazol-2-ylamino)propyl]-3-chloro-5,6-dimethoxy-4-(4-piperidyl)benzamide CAS Name: 2-[3-(1,3-benzothiazol-2-ylamino)propyl]-3-chloro-5,6-dimethoxy-4-(4-piperidinyl)benzamide IUPAC Name: 2-[3-(1,3-benzothiazol-2-ylamino)propyl]-3-chloro-5,6-dimethoxy-4-piperidin-4-ylbenzamide Traditional Name: 2-[3-(1,3-benzothiazol-2-ylamino)propyl]-3-chloro-5,6-dimethoxy-4-(4-piperidyl)benzamide Formula: C24H29ClN4O3S MolecularWeight: 489.03006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1C2CCNCC2)Cl)CCCNC3=NC4=CC=CC=C4S3)C(=O)N)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1C2CCNCC2)Cl)CCCNC3=NC4=CC=CC=C4S3)C(=O)N)OC

InChI

InChI=1S/C24H29ClN4O3S/c1-31-21-18(14-9-12-27-13-10-14)20(25)15(19(23(26)30)22(21)32-2)6-5-11-28-24-29-16-7-3-4-8-17(16)33-24/h3-4,7-8,14,27H,5-6,9-13H2,1-2H3,(H2,26,30)(H,28,29)