N-[5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-oxo-chromene-3-carboxamide CAS Name: N-[5-[(4-nitrophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-oxochromene-3-carboxamide Traditional Name: 2-keto-N-[5-[(4-nitrobenzyl)thio]-1,3,4-thiadiazol-2-yl]chromene-3-carboxamide Formula: C19H12N4O5S2 MolecularWeight: 440.45238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H12N4O5S2/c24-16(14-9-12-3-1-2-4-15(12)28-17(14)25)20-18-21-22-19(30-18)29-10-11-5-7-13(8-6-11)23(26)27/h1-9H,10H2,(H,20,21,24)