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

Systemtic Name: 4-(2,2-dimethyl-5-phenyl-4-propan-2-ylsulfanyl-pyrrol-3-yl)-2-methyl-pyridine Openeye Name: 4-(4-isopropylsulfanyl-2,2-dimethyl-5-phenyl-pyrrol-3-yl)-2-methyl-pyridine CAS Name: 4-[2,2-dimethyl-5-phenyl-4-(propan-2-ylthio)-3-pyrrolyl]-2-methylpyridine IUPAC Name: 4-(2,2-dimethyl-5-phenyl-4-propan-2-ylsulfanylpyrrol-3-yl)-2-methylpyridine Traditional Name: 4-[4-(isopropylthio)-2,2-dimethyl-5-phenyl-pyrrol-3-yl]-2-methyl-pyridine Formula: C21H24N2S MolecularWeight: 336.49366

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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/C21H24N2S/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/h6-14H,1-5H3