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

Systemtic Name: N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[1-(2,4-dimethylthiazol-5-yl)ethyl]-3-(2-nitroanilino)propanamide CAS Name: N-[1-(2,4-dimethyl-5-thiazolyl)ethyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-3-(2-nitroanilino)propanamide Traditional Name: N-[1-(2,4-dimethylthiazol-5-yl)ethyl]-3-(2-nitroanilino)propionamide Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)C(C)NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C)C(C)NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O3S/c1-10-16(24-12(3)18-10)11(2)19-15(21)8-9-17-13-6-4-5-7-14(13)20(22)23/h4-7,11,17H,8-9H2,1-3H3,(H,19,21)