3-chloranyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(3-methylpiperidino)sulfonylphenyl]benzothiophene-2-carboxamide Formula: C21H21ClN2O3S2 MolecularWeight: 448.98604

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H21ClN2O3S2/c1-14-5-4-12-24(13-14)29(26,27)16-10-8-15(9-11-16)23-21(25)20-19(22)17-6-2-3-7-18(17)28-20/h2-3,6-11,14H,4-5,12-13H2,1H3,(H,23,25)