N-[(2S)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1S)-1-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[(2S)-1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[(2S)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[(1S)-1-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-(methylthio)propyl]benzamide Formula: C24H27N3O2S2 MolecularWeight: 453.62008

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCC(CC1)C2=NC3=CC=CC=C3S2)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCC(CC1)C2=NC3=CC=CC=C3S2)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O2S2/c1-30-16-13-20(25-22(28)17-7-3-2-4-8-17)24(29)27-14-11-18(12-15-27)23-26-19-9-5-6-10-21(19)31-23/h2-10,18,20H,11-16H2,1H3,(H,25,28)/t20-/m0/s1