1-chloranyl-N-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]benzo[e][1]benzothiole-2-carboxamide

Systemtic Name: 1-chloranyl-N-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]benzo[e][1]benzothiole-2-carboxamide Openeye Name: 1-chloro-N-[4-[(2-ethyl-1-piperidyl)sulfonyl]phenyl]benzo[e]benzothiophene-2-carboxamide CAS Name: 1-chloro-N-[4-[(2-ethyl-1-piperidinyl)sulfonyl]phenyl]-2-benzo[e][1]benzothiolecarboxamide IUPAC Name: 1-chloro-N-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]benzo[e][1]benzothiole-2-carboxamide Traditional Name: 1-chloro-N-[4-(2-ethylpiperidino)sulfonylphenyl]benzo[e]benzothiophene-2-carboxamide Formula: C26H25ClN2O3S2 MolecularWeight: 513.0713

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)C=CC5=CC=CC=C54)Cl

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)C=CC5=CC=CC=C54)Cl

InChI

InChI=1S/C26H25ClN2O3S2/c1-2-19-8-5-6-16-29(19)34(31,32)20-13-11-18(12-14-20)28-26(30)25-24(27)23-21-9-4-3-7-17(21)10-15-22(23)33-25/h3-4,7,9-15,19H,2,5-6,8,16H2,1H3,(H,28,30)