1-[[[3-[(4-propan-2-ylphenoxy)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]naphthalen-2-one

Systemtic Name: 1-[[[3-[(4-propan-2-ylphenoxy)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]naphthalen-2-one Openeye Name: 1-[[[3-[(4-isopropylphenoxy)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]naphthalen-2-one CAS Name: 1-[[[3-[(4-propan-2-ylphenoxy)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-naphthalenone IUPAC Name: 1-[[[3-[(4-propan-2-ylphenoxy)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]naphthalen-2-one Traditional Name: 1-[[[3-[(4-isopropylphenoxy)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]naphthalen-2-one Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2=NNC(=S)N2NC=C3C(=O)C=CC4=CC=CC=C43

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC2=NNC(=S)N2NC=C3C(=O)C=CC4=CC=CC=C43

InChI

InChI=1S/C23H22N4O2S/c1-15(2)16-7-10-18(11-8-16)29-14-22-25-26-23(30)27(22)24-13-20-19-6-4-3-5-17(19)9-12-21(20)28/h3-13,15,24H,14H2,1-2H3,(H,26,30)