2-oxidanylidene-5-(pyridin-2-ylmethylsulfanyl)-4-(1,3,4-thiadiazol-2-yl)chromene-3-carboxamide

Systemtic Name: 2-oxidanylidene-5-(pyridin-2-ylmethylsulfanyl)-4-(1,3,4-thiadiazol-2-yl)chromene-3-carboxamide Openeye Name: 2-oxo-5-(2-pyridylmethylsulfanyl)-4-(1,3,4-thiadiazol-2-yl)chromene-3-carboxamide CAS Name: 2-oxo-5-(2-pyridinylmethylthio)-4-(1,3,4-thiadiazol-2-yl)-1-benzopyran-3-carboxamide IUPAC Name: 2-oxo-5-(pyridin-2-ylmethylsulfanyl)-4-(1,3,4-thiadiazol-2-yl)chromene-3-carboxamide Traditional Name: 2-keto-5-(2-pyridylmethylthio)-4-(1,3,4-thiadiazol-2-yl)chromene-3-carboxamide Formula: C18H12N4O3S2 MolecularWeight: 396.44288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CSC2=CC=CC3=C2C(=C(C(=O)O3)C(=O)N)C4=NN=CS4

Isomeric SMILES

C1=CC=NC(=C1)CSC2=CC=CC3=C2C(=C(C(=O)O3)C(=O)N)C4=NN=CS4

InChI

InChI=1S/C18H12N4O3S2/c19-16(23)15-14(17-22-21-9-27-17)13-11(25-18(15)24)5-3-6-12(13)26-8-10-4-1-2-7-20-10/h1-7,9H,8H2,(H2,19,23)