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

Systemtic Name: N-ethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: N-ethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: N-ethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: N-ethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: N-ethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O3S/c1-5-20-19(26)22-10-9-21-8-6-7-14(21)17(22)13-11-15(23-2)18(25-4)16(12-13)24-3/h6-8,11-12,17H,5,9-10H2,1-4H3,(H,20,26)