[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2,5-dimethyl-1-pyridin-2-yl-pyrrol-3-yl)methanone

Systemtic Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2,5-dimethyl-1-pyridin-2-yl-pyrrol-3-yl)methanone Openeye Name: [(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-[2,5-dimethyl-1-(2-pyridyl)pyrrol-3-yl]methanone CAS Name: [(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-[2,5-dimethyl-1-(2-pyridinyl)-3-pyrrolyl]methanone IUPAC Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2,5-dimethyl-1-pyridin-2-ylpyrrol-3-yl)methanone Traditional Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidino]-[2,5-dimethyl-1-(2-pyridyl)pyrrol-3-yl]methanone Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=N2)C)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=N2)C)C(=O)N3CCC[C@@H](C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H24N4OS/c1-16-14-19(17(2)28(16)22-11-5-6-12-25-22)24(29)27-13-7-8-18(15-27)23-26-20-9-3-4-10-21(20)30-23/h3-6,9-12,14,18H,7-8,13,15H2,1-2H3/t18-/m0/s1