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

Systemtic Name: N-(3,5-dimethylphenyl)-1-(4-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-1-(4-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-1-(4-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-1-(4-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-1-(4-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3OS/c1-16-13-17(2)15-19(14-16)24-23(28)26-12-11-25-10-4-5-21(25)22(26)18-6-8-20(27-3)9-7-18/h4-10,13-15,22H,11-12H2,1-3H3,(H,24,28)