3-[3-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-[(6-chloro-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-[(6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-[(6-chloro-7-methyl-2-oxochromen-4-yl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-[(6-chloro-2-keto-7-methyl-chromen-4-yl)methylthio]-5-cyclopropyl-1,2,4-triazol-4-yl]propionamide Formula: C19H19ClN4O3S MolecularWeight: 418.89716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(N3CCC(=O)N)C4CC4)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(N3CCC(=O)N)C4CC4)Cl

InChI

InChI=1S/C19H19ClN4O3S/c1-10-6-15-13(8-14(10)20)12(7-17(26)27-15)9-28-19-23-22-18(11-2-3-11)24(19)5-4-16(21)25/h6-8,11H,2-5,9H2,1H3,(H2,21,25)