N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[4-(2,5-dimethylphenyl)thiazol-2-yl]-3-(2-nitroanilino)propanamide CAS Name: N-[4-(2,5-dimethylphenyl)-2-thiazolyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-3-(2-nitroanilino)propanamide Traditional Name: N-[4-(2,5-dimethylphenyl)thiazol-2-yl]-3-(2-nitroanilino)propionamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CSC(=N2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CSC(=N2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3S/c1-13-7-8-14(2)15(11-13)17-12-28-20(22-17)23-19(25)9-10-21-16-5-3-4-6-18(16)24(26)27/h3-8,11-12,21H,9-10H2,1-2H3,(H,22,23,25)