(1S)-1-(4-chlorophenyl)-N-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide

Systemtic Name: (1S)-1-(4-chlorophenyl)-N-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: (1S)-1-(4-chlorophenyl)-N-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: (1S)-1-(4-chlorophenyl)-N-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: (1S)-1-(4-chlorophenyl)-N-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: (1S)-1-(4-chlorophenyl)-N-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C16H18ClN3S MolecularWeight: 319.85222

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCN2C=CC=C2C1C3=CC=C(C=C3)Cl

Isomeric SMILES

CCNC(=S)N1CCN2C=CC=C2[C@@H]1C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H18ClN3S/c1-2-18-16(21)20-11-10-19-9-3-4-14(19)15(20)12-5-7-13(17)8-6-12/h3-9,15H,2,10-11H2,1H3,(H,18,21)/t15-/m0/s1