5-azanylidene-2-(1,3-benzodioxol-5-ylmethylidene)-4-(5-ethyl-1,3,4-thiadiazol-2-yl)thiolan-3-one

Systemtic Name: 5-azanylidene-2-(1,3-benzodioxol-5-ylmethylidene)-4-(5-ethyl-1,3,4-thiadiazol-2-yl)thiolan-3-one Openeye Name: 2-(1,3-benzodioxol-5-ylmethylene)-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-tetrahydrothiophen-3-one CAS Name: 2-(1,3-benzodioxol-5-ylmethylidene)-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-3-thiolanone IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylidene)-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-iminothiolan-3-one Traditional Name: 4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-2-piperonylidene-tetrahydrothiophen-3-one Formula: C16H13N3O3S2 MolecularWeight: 359.42272

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)C2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=N

Isomeric SMILES

CCC1=NN=C(S1)C2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=N

InChI

InChI=1S/C16H13N3O3S2/c1-2-12-18-19-16(24-12)13-14(20)11(23-15(13)17)6-8-3-4-9-10(5-8)22-7-21-9/h3-6,13,17H,2,7H2,1H3