N-(3,5-dimethylphenyl)-1-pyridin-3-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide

Systemtic Name: N-(3,5-dimethylphenyl)-1-pyridin-3-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-1-(3-pyridyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-1-(3-pyridinyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-1-pyridin-3-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-1-(3-pyridyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCN3C=CC=C3C2C4=CN=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCN3C=CC=C3C2C4=CN=CC=C4)C

InChI

InChI=1S/C21H22N4S/c1-15-11-16(2)13-18(12-15)23-21(26)25-10-9-24-8-4-6-19(24)20(25)17-5-3-7-22-14-17/h3-8,11-14,20H,9-10H2,1-2H3,(H,23,26)