4-(5,5-dimethyl-2-phenyl-3-propan-2-ylsulfanyl-1,2-dihydropyrrol-4-yl)-2-methyl-pyridine

Systemtic Name: 4-(5,5-dimethyl-2-phenyl-3-propan-2-ylsulfanyl-1,2-dihydropyrrol-4-yl)-2-methyl-pyridine Openeye Name: 4-(3-isopropylsulfanyl-5,5-dimethyl-2-phenyl-1,2-dihydropyrrol-4-yl)-2-methyl-pyridine CAS Name: 4-[5,5-dimethyl-2-phenyl-3-(propan-2-ylthio)-1,2-dihydropyrrol-4-yl]-2-methylpyridine IUPAC Name: 4-(5,5-dimethyl-2-phenyl-3-propan-2-ylsulfanyl-1,2-dihydropyrrol-4-yl)-2-methylpyridine Traditional Name: 4-[4-(isopropylthio)-2,2-dimethyl-5-phenyl-3-pyrrolin-3-yl]-2-methyl-pyridine Formula: C21H26N2S MolecularWeight: 338.50954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=C(C(NC2(C)C)C3=CC=CC=C3)SC(C)C

Isomeric SMILES

CC1=NC=CC(=C1)C2=C(C(NC2(C)C)C3=CC=CC=C3)SC(C)C

InChI

InChI=1S/C21H26N2S/c1-14(2)24-20-18(17-11-12-22-15(3)13-17)21(4,5)23-19(20)16-9-7-6-8-10-16/h6-14,19,23H,1-5H3