1-oxidanylidene-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)isothiochromene-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)isothiochromene-3-carboxamide Openeye Name: 1-oxo-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)isothiochromene-3-carboxamide CAS Name: 1-oxo-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]-2-benzothiopyran-3-carboxamide IUPAC Name: 1-oxo-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)isothiochromene-3-carboxamide Traditional Name: 1-keto-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]isothiochromene-3-carboxamide Formula: C15H13N3O2S3 MolecularWeight: 363.47762

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)C2=CC3=CC=CC=C3C(=O)S2

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)C2=CC3=CC=CC=C3C(=O)S2

InChI

InChI=1S/C15H13N3O2S3/c1-2-7-21-15-18-17-14(23-15)16-12(19)11-8-9-5-3-4-6-10(9)13(20)22-11/h3-6,8H,2,7H2,1H3,(H,16,17,19)