2-methyl-6-[(3S)-1-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]piperidin-3-yl]-1H-pyrimidin-4-one

Systemtic Name: 2-methyl-6-[(3S)-1-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]piperidin-3-yl]-1H-pyrimidin-4-one Openeye Name: 2-methyl-6-[(3S)-1-[(1-thiazol-2-ylpyrrol-2-yl)methyl]-3-piperidyl]-1H-pyrimidin-4-one CAS Name: 2-methyl-6-[(3S)-1-[[1-(2-thiazolyl)-2-pyrrolyl]methyl]-3-piperidinyl]-1H-pyrimidin-4-one IUPAC Name: 2-methyl-6-[(3S)-1-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]piperidin-3-yl]-1H-pyrimidin-4-one Traditional Name: 2-methyl-6-[(3S)-1-[(1-thiazol-2-ylpyrrol-2-yl)methyl]-3-piperidyl]-1H-pyrimidin-4-one Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C=C(N1)C2CCCN(C2)CC3=CC=CN3C4=NC=CS4

Isomeric SMILES

CC1=NC(=O)C=C(N1)[C@H]2CCCN(C2)CC3=CC=CN3C4=NC=CS4

InChI

InChI=1S/C18H21N5OS/c1-13-20-16(10-17(24)21-13)14-4-2-7-22(11-14)12-15-5-3-8-23(15)18-19-6-9-25-18/h3,5-6,8-10,14H,2,4,7,11-12H2,1H3,(H,20,21,24)/t14-/m0/s1