[2-methyl-6-(3-methyl-1,2,4-triazol-4-yl)phenyl]-(3-propylsulfanylphenyl)methanone

Systemtic Name: [2-methyl-6-(3-methyl-1,2,4-triazol-4-yl)phenyl]-(3-propylsulfanylphenyl)methanone Openeye Name: [2-methyl-6-(3-methyl-1,2,4-triazol-4-yl)phenyl]-(3-propylsulfanylphenyl)methanone CAS Name: [2-methyl-6-(3-methyl-1,2,4-triazol-4-yl)phenyl]-[3-(propylthio)phenyl]methanone IUPAC Name: [2-methyl-6-(3-methyl-1,2,4-triazol-4-yl)phenyl]-(3-propylsulfanylphenyl)methanone Traditional Name: [2-methyl-6-(3-methyl-1,2,4-triazol-4-yl)phenyl]-[3-(propylthio)phenyl]methanone Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC=CC(=C1)C(=O)C2=C(C=CC=C2N3C=NN=C3C)C

Isomeric SMILES

CCCSC1=CC=CC(=C1)C(=O)C2=C(C=CC=C2N3C=NN=C3C)C

InChI

InChI=1S/C20H21N3OS/c1-4-11-25-17-9-6-8-16(12-17)20(24)19-14(2)7-5-10-18(19)23-13-21-22-15(23)3/h5-10,12-13H,4,11H2,1-3H3