[5-[1-(5-azanylpyridin-2-yl)ethyl]-3-methyl-1H-pyrrol-2-yl]-(4-methylphenyl)methanethione

Systemtic Name: [5-[1-(5-azanylpyridin-2-yl)ethyl]-3-methyl-1H-pyrrol-2-yl]-(4-methylphenyl)methanethione Openeye Name: [5-[1-(5-amino-2-pyridyl)ethyl]-3-methyl-1H-pyrrol-2-yl]-(p-tolyl)methanethione CAS Name: [5-[1-(5-amino-2-pyridinyl)ethyl]-3-methyl-1H-pyrrol-2-yl]-(4-methylphenyl)methanethione IUPAC Name: [5-[1-(5-aminopyridin-2-yl)ethyl]-3-methyl-1H-pyrrol-2-yl]-(4-methylphenyl)methanethione Traditional Name: [5-[1-(5-amino-2-pyridyl)ethyl]-3-methyl-1H-pyrrol-2-yl]-(p-tolyl)methanethione Formula: C20H21N3S MolecularWeight: 335.46584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=S)C2=C(C=C(N2)C(C)C3=NC=C(C=C3)N)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=S)C2=C(C=C(N2)C(C)C3=NC=C(C=C3)N)C

InChI

InChI=1S/C20H21N3S/c1-12-4-6-15(7-5-12)20(24)19-13(2)10-18(23-19)14(3)17-9-8-16(21)11-22-17/h4-11,14,23H,21H2,1-3H3