N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-[(3S)-3-methylpiperidino]sulfonyl-benzamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(C)C(C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(C)[C@@H](C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H27N3O3S2/c1-16-7-6-14-26(15-16)31(28,29)19-12-10-18(11-13-19)23(27)25(3)17(2)22-24-20-8-4-5-9-21(20)30-22/h4-5,8-13,16-17H,6-7,14-15H2,1-3H3/t16-,17-/m0/s1