[(3S)-1-(5-chloranylthiophen-2-yl)sulfonylpiperidin-3-yl]-(4-methoxy-2-methyl-phenyl)methanone

Systemtic Name: [(3S)-1-(5-chloranylthiophen-2-yl)sulfonylpiperidin-3-yl]-(4-methoxy-2-methyl-phenyl)methanone Openeye Name: [(3S)-1-[(5-chloro-2-thienyl)sulfonyl]-3-piperidyl]-(4-methoxy-2-methyl-phenyl)methanone CAS Name: [(3S)-1-[(5-chloro-2-thiophenyl)sulfonyl]-3-piperidinyl]-(4-methoxy-2-methylphenyl)methanone IUPAC Name: [(3S)-1-(5-chlorothiophen-2-yl)sulfonylpiperidin-3-yl]-(4-methoxy-2-methylphenyl)methanone Traditional Name: [(3S)-1-[(5-chloro-2-thienyl)sulfonyl]-3-piperidyl]-(4-methoxy-2-methyl-phenyl)methanone Formula: C18H20ClNO4S2 MolecularWeight: 413.9387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C18H20ClNO4S2/c1-12-10-14(24-2)5-6-15(12)18(21)13-4-3-9-20(11-13)26(22,23)17-8-7-16(19)25-17/h5-8,10,13H,3-4,9,11H2,1-2H3/t13-/m0/s1