1-(2,5-dimethoxyphenyl)-N-(2-ethyl-6-methyl-phenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide

Systemtic Name: 1-(2,5-dimethoxyphenyl)-N-(2-ethyl-6-methyl-phenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: 1-(2,5-dimethoxyphenyl)-N-(2-ethyl-6-methyl-phenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: 1-(2,5-dimethoxyphenyl)-N-(2-ethyl-6-methylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: 1-(2,5-dimethoxyphenyl)-N-(2-ethyl-6-methylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: 1-(2,5-dimethoxyphenyl)-N-(2-ethyl-6-methyl-phenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O2S/c1-5-18-9-6-8-17(2)23(18)26-25(31)28-15-14-27-13-7-10-21(27)24(28)20-16-19(29-3)11-12-22(20)30-4/h6-13,16,24H,5,14-15H2,1-4H3,(H,26,31)