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

Systemtic Name: 3-[5-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(7-ethyl-2-oxo-chromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[(7-ethyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-methyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(7-ethyl-2-oxochromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[(7-ethyl-2-keto-chromen-4-yl)methylthio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(N3C)CCC(=O)N

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(N3C)CCC(=O)N

InChI

InChI=1S/C18H20N4O3S/c1-3-11-4-5-13-12(9-17(24)25-14(13)8-11)10-26-18-21-20-16(22(18)2)7-6-15(19)23/h4-5,8-9H,3,6-7,10H2,1-2H3,(H2,19,23)