N-[(2-morpholin-4-yl-4-thiophen-2-yl-1,3-thiazol-5-yl)carbothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(2-morpholin-4-yl-4-thiophen-2-yl-1,3-thiazol-5-yl)carbothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-morpholino-4-(2-thienyl)thiazole-5-carbothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[2-(4-morpholinyl)-4-thiophen-2-yl-5-thiazolyl]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(2-morpholin-4-yl-4-thiophen-2-yl-1,3-thiazole-5-carbothioyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-morpholino-4-(2-thienyl)thiazole-5-carbothioyl]-piperonylamide Formula: C20H17N3O4S3 MolecularWeight: 459.56168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=C(S2)C(=S)NC(=O)C3=CC4=C(C=C3)OCO4)C5=CC=CS5

Isomeric SMILES

C1COCCN1C2=NC(=C(S2)C(=S)NC(=O)C3=CC4=C(C=C3)OCO4)C5=CC=CS5

InChI

InChI=1S/C20H17N3O4S3/c24-18(12-3-4-13-14(10-12)27-11-26-13)22-19(28)17-16(15-2-1-9-29-15)21-20(30-17)23-5-7-25-8-6-23/h1-4,9-10H,5-8,11H2,(H,22,24,28)