N-[2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-3,4-dimethyl-benzamide Openeye Name: N-[2-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-oxo-ethyl]-3,4-dimethyl-benzamide CAS Name: N-[2-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-oxoethyl]-3,4-dimethylbenzamide IUPAC Name: N-[2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethyl]-3,4-dimethylbenzamide Traditional Name: N-[2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-2-keto-ethyl]-3,4-dimethyl-benzamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCC[C@H](C2)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C23H25N3O2S/c1-15-9-10-17(12-16(15)2)22(28)24-13-21(27)26-11-5-6-18(14-26)23-25-19-7-3-4-8-20(19)29-23/h3-4,7-10,12,18H,5-6,11,13-14H2,1-2H3,(H,24,28)/t18-/m1/s1