N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide

Systemtic Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide Openeye Name: 2-allyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxamide IUPAC Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-prop-2-enylisoindole-5-carboxamide Traditional Name: 2-allyl-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-1,3-diketo-isoindoline-5-carboxamide Formula: C16H14N4O3S2 MolecularWeight: 374.43736

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

InChI

InChI=1S/C16H14N4O3S2/c1-3-7-20-13(22)10-6-5-9(8-11(10)14(20)23)12(21)17-15-18-19-16(25-15)24-4-2/h3,5-6,8H,1,4,7H2,2H3,(H,17,18,21)