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

Systemtic Name: 4-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-3-(2-methylphenyl)-2-sulfanylidene-1,3-thiazole-5-carboxamide Openeye Name: 4-amino-N-(1,3-benzodioxol-5-ylmethyl)-3-(o-tolyl)-2-thioxo-thiazole-5-carboxamide CAS Name: 4-amino-N-(1,3-benzodioxol-5-ylmethyl)-3-(2-methylphenyl)-2-sulfanylidene-5-thiazolecarboxamide IUPAC Name: 4-amino-N-(1,3-benzodioxol-5-ylmethyl)-3-(2-methylphenyl)-2-sulfanylidene-1,3-thiazole-5-carboxamide Traditional Name: 4-amino-3-(o-tolyl)-N-piperonyl-2-thioxo-4-thiazoline-5-carboxamide Formula: C19H17N3O3S2 MolecularWeight: 399.48658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(SC2=S)C(=O)NCC3=CC4=C(C=C3)OCO4)N

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(SC2=S)C(=O)NCC3=CC4=C(C=C3)OCO4)N

InChI

InChI=1S/C19H17N3O3S2/c1-11-4-2-3-5-13(11)22-17(20)16(27-19(22)26)18(23)21-9-12-6-7-14-15(8-12)25-10-24-14/h2-8H,9-10,20H2,1H3,(H,21,23)