6-chloranyl-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: 6-chloranyl-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-oxidanylidene-chromene-2-carboxamide Openeye Name: 6-chloro-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-oxo-chromene-2-carboxamide CAS Name: 6-chloro-N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: 6-chloro-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-oxochromene-2-carboxamide Traditional Name: 6-chloro-N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-4-keto-chromene-2-carboxamide Formula: C21H23ClN4O3S MolecularWeight: 446.95032

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C21H23ClN4O3S/c1-30-21-25-24-19(26(21)14-5-2-3-6-14)7-4-10-23-20(28)18-12-16(27)15-11-13(22)8-9-17(15)29-18/h8-9,11-12,14H,2-7,10H2,1H3,(H,23,28)