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

Systemtic Name: (1S)-N-(3,5-dimethylphenyl)-1-thiophen-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: (1S)-N-(3,5-dimethylphenyl)-1-(2-thienyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: (1S)-N-(3,5-dimethylphenyl)-1-thiophen-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: (1S)-N-(3,5-dimethylphenyl)-1-thiophen-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: (1S)-N-(3,5-dimethylphenyl)-1-(2-thienyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C20H21N3S2 MolecularWeight: 367.53084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCN3C=CC=C3C2C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCN3C=CC=C3[C@H]2C4=CC=CS4)C

InChI

InChI=1S/C20H21N3S2/c1-14-11-15(2)13-16(12-14)21-20(24)23-9-8-22-7-3-5-17(22)19(23)18-6-4-10-25-18/h3-7,10-13,19H,8-9H2,1-2H3,(H,21,24)/t19-/m0/s1