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

Systemtic Name: N-tert-butyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Openeye Name: N-tert-butyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide CAS Name: N-tert-butyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide IUPAC Name: N-tert-butyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Traditional Name: N-tert-butyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O3S/c1-21(2,3)22-20(28)24-11-10-23-9-7-8-15(23)18(24)14-12-16(25-4)19(27-6)17(13-14)26-5/h7-9,12-13,18H,10-11H2,1-6H3,(H,22,28)