(3-methylthiophen-2-yl)-[(3S)-1-[(1-pyridin-2-ylpyrrol-2-yl)methyl]piperidin-3-yl]methanone

Systemtic Name: (3-methylthiophen-2-yl)-[(3S)-1-[(1-pyridin-2-ylpyrrol-2-yl)methyl]piperidin-3-yl]methanone Openeye Name: (3-methyl-2-thienyl)-[(3S)-1-[[1-(2-pyridyl)pyrrol-2-yl]methyl]-3-piperidyl]methanone CAS Name: (3-methyl-2-thiophenyl)-[(3S)-1-[[1-(2-pyridinyl)-2-pyrrolyl]methyl]-3-piperidinyl]methanone IUPAC Name: (3-methylthiophen-2-yl)-[(3S)-1-[(1-pyridin-2-ylpyrrol-2-yl)methyl]piperidin-3-yl]methanone Traditional Name: (3-methyl-2-thienyl)-[(3S)-1-[[1-(2-pyridyl)pyrrol-2-yl]methyl]-3-piperidyl]methanone Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)C2CCCN(C2)CC3=CC=CN3C4=CC=CC=N4

Isomeric SMILES

CC1=C(SC=C1)C(=O)[C@H]2CCCN(C2)CC3=CC=CN3C4=CC=CC=N4

InChI

InChI=1S/C21H23N3OS/c1-16-9-13-26-21(16)20(25)17-6-4-11-23(14-17)15-18-7-5-12-24(18)19-8-2-3-10-22-19/h2-3,5,7-10,12-13,17H,4,6,11,14-15H2,1H3/t17-/m0/s1