(2R)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-methylquinolin-2-yl)sulfanyl-propan-1-one

Systemtic Name: (2R)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-methylquinolin-2-yl)sulfanyl-propan-1-one Openeye Name: (2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(4-methyl-2-quinolyl)sulfanyl]propan-1-one CAS Name: (2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(4-methyl-2-quinolinyl)thio]-1-propanone IUPAC Name: (2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-methylquinolin-2-yl)sulfanylpropan-1-one Traditional Name: (2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(4-methyl-2-quinolyl)thio]propan-1-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)C3=C(C(=C(N3)C)C(=O)C)C

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)S[C@H](C)C(=O)C3=C(C(=C(N3)C)C(=O)C)C

InChI

InChI=1S/C21H22N2O2S/c1-11-10-18(23-17-9-7-6-8-16(11)17)26-15(5)21(25)20-12(2)19(14(4)24)13(3)22-20/h6-10,15,22H,1-5H3/t15-/m1/s1