2-(3-methyl-4-nitro-phenoxy)-N-[[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl]butanamide

Systemtic Name: 2-(3-methyl-4-nitro-phenoxy)-N-[[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl]butanamide Openeye Name: 2-(3-methyl-4-nitro-phenoxy)-N-[[2-(m-tolyl)thiazol-4-yl]methyl]butanamide CAS Name: 2-(3-methyl-4-nitrophenoxy)-N-[[2-(3-methylphenyl)-4-thiazolyl]methyl]butanamide IUPAC Name: 2-(3-methyl-4-nitrophenoxy)-N-[[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl]butanamide Traditional Name: 2-(3-methyl-4-nitro-phenoxy)-N-[[2-(m-tolyl)thiazol-4-yl]methyl]butyramide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CSC(=N1)C2=CC(=CC=C2)C)OC3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NCC1=CSC(=N1)C2=CC(=CC=C2)C)OC3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H23N3O4S/c1-4-20(29-18-8-9-19(25(27)28)15(3)11-18)21(26)23-12-17-13-30-22(24-17)16-7-5-6-14(2)10-16/h5-11,13,20H,4,12H2,1-3H3,(H,23,26)