N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]cyclohexanecarboxamide

Systemtic Name: N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]cyclohexanecarboxamide Openeye Name: N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-oxo-ethyl]cyclohexanecarboxamide CAS Name: N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-oxoethyl]cyclohexanecarboxamide IUPAC Name: N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethyl]cyclohexanecarboxamide Traditional Name: N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)piperidino]-2-keto-ethyl]cyclohexanecarboxamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NCC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCC(CC1)C(=O)NCC(=O)N2CCC[C@@H](C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H27N3O2S/c25-19(13-22-20(26)15-7-2-1-3-8-15)24-12-6-9-16(14-24)21-23-17-10-4-5-11-18(17)27-21/h4-5,10-11,15-16H,1-3,6-9,12-14H2,(H,22,26)/t16-/m0/s1