N-(2-ethyl-6-methyl-phenyl)-1-pyridin-3-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-1-pyridin-3-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-1-(3-pyridyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: N-(2-ethyl-6-methylphenyl)-1-(3-pyridinyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-1-pyridin-3-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-1-(3-pyridyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C22H24N4S MolecularWeight: 376.51776

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)N2CCN3C=CC=C3C2C4=CN=CC=C4)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)N2CCN3C=CC=C3C2C4=CN=CC=C4)C

InChI

InChI=1S/C22H24N4S/c1-3-17-8-4-7-16(2)20(17)24-22(27)26-14-13-25-12-6-10-19(25)21(26)18-9-5-11-23-15-18/h4-12,15,21H,3,13-14H2,1-2H3,(H,24,27)