N-(1-benzothiophen-3-ylmethyl)-2-[1-(3-chloranyl-4-methyl-phenyl)sulfonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(1-benzothiophen-3-ylmethyl)-2-[1-(3-chloranyl-4-methyl-phenyl)sulfonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(benzothiophen-3-ylmethyl)-2-[1-(3-chloro-4-methyl-phenyl)sulfonyl-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(1-benzothiophen-3-ylmethyl)-2-[1-(3-chloro-4-methylphenyl)sulfonyl-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(1-benzothiophen-3-ylmethyl)-2-[1-(3-chloro-4-methylphenyl)sulfonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(benzothiophen-3-ylmethyl)-2-[1-(3-chloro-4-methyl-phenyl)sulfonyl-4-piperidyl]thiazole-4-carboxamide Formula: C25H24ClN3O3S3 MolecularWeight: 546.12436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NCC4=CSC5=CC=CC=C54)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NCC4=CSC5=CC=CC=C54)Cl

InChI

InChI=1S/C25H24ClN3O3S3/c1-16-6-7-19(12-21(16)26)35(31,32)29-10-8-17(9-11-29)25-28-22(15-34-25)24(30)27-13-18-14-33-23-5-3-2-4-20(18)23/h2-7,12,14-15,17H,8-11,13H2,1H3,(H,27,30)