4-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-3-(2,5-dimethoxyphenyl)-2-sulfanylidene-1,3-thiazole-5-carboxamide

Systemtic Name: 4-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-3-(2,5-dimethoxyphenyl)-2-sulfanylidene-1,3-thiazole-5-carboxamide Openeye Name: 4-amino-N-(1,3-benzodioxol-5-ylmethyl)-3-(2,5-dimethoxyphenyl)-2-thioxo-thiazole-5-carboxamide CAS Name: 4-amino-N-(1,3-benzodioxol-5-ylmethyl)-3-(2,5-dimethoxyphenyl)-2-sulfanylidene-5-thiazolecarboxamide IUPAC Name: 4-amino-N-(1,3-benzodioxol-5-ylmethyl)-3-(2,5-dimethoxyphenyl)-2-sulfanylidene-1,3-thiazole-5-carboxamide Traditional Name: 4-amino-3-(2,5-dimethoxyphenyl)-N-piperonyl-2-thioxo-4-thiazoline-5-carboxamide Formula: C20H19N3O5S2 MolecularWeight: 445.51196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=C(SC2=S)C(=O)NCC3=CC4=C(C=C3)OCO4)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=C(SC2=S)C(=O)NCC3=CC4=C(C=C3)OCO4)N

InChI

InChI=1S/C20H19N3O5S2/c1-25-12-4-6-14(26-2)13(8-12)23-18(21)17(30-20(23)29)19(24)22-9-11-3-5-15-16(7-11)28-10-27-15/h3-8H,9-10,21H2,1-2H3,(H,22,24)