3,4-dimethoxy-N-[[4-methyl-5-(1-oxidanylidene-1-phenylazanyl-propan-2-yl)sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[[4-methyl-5-(1-oxidanylidene-1-phenylazanyl-propan-2-yl)sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: N-[[5-(2-anilino-1-methyl-2-oxo-ethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxy-benzamide CAS Name: N-[[5-[(1-anilino-1-oxopropan-2-yl)thio]-4-methyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide IUPAC Name: N-[[5-(1-anilino-1-oxopropan-2-yl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide Traditional Name: N-[[5-[(2-anilino-2-keto-1-methyl-ethyl)thio]-4-methyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxy-benzamide Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=NN=C(N2C)CNC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)SC2=NN=C(N2C)CNC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H25N5O4S/c1-14(20(28)24-16-8-6-5-7-9-16)32-22-26-25-19(27(22)2)13-23-21(29)15-10-11-17(30-3)18(12-15)31-4/h5-12,14H,13H2,1-4H3,(H,23,29)(H,24,28)