6-chloranyl-4-oxidanylidene-N-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]chromene-2-carboxamide

Systemtic Name: 6-chloranyl-4-oxidanylidene-N-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]chromene-2-carboxamide Openeye Name: N-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)-6-chloro-4-oxo-chromene-2-carboxamide CAS Name: 6-chloro-4-oxo-N-[3-(phenylmethylthio)-1,2,4-thiadiazol-5-yl]-1-benzopyran-2-carboxamide IUPAC Name: N-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)-6-chloro-4-oxochromene-2-carboxamide Traditional Name: N-[3-(benzylthio)-1,2,4-thiadiazol-5-yl]-6-chloro-4-keto-chromene-2-carboxamide Formula: C19H12ClN3O3S2 MolecularWeight: 429.89988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NSC(=N2)NC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NSC(=N2)NC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C19H12ClN3O3S2/c20-12-6-7-15-13(8-12)14(24)9-16(26-15)17(25)21-18-22-19(23-28-18)27-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,21,22,23,25)