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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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