N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[5-methyl-4-(p-tolyl)thiazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[5-methyl-4-(4-methylphenyl)-2-thiazolyl]-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[5-methyl-4-(p-tolyl)thiazol-2-yl]-3-(4-nitropyrazol-1-yl)propionamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CCN3C=C(C=N3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CCN3C=C(C=N3)[N+](=O)[O-])C

InChI

InChI=1S/C17H17N5O3S/c1-11-3-5-13(6-4-11)16-12(2)26-17(20-16)19-15(23)7-8-21-10-14(9-18-21)22(24)25/h3-6,9-10H,7-8H2,1-2H3,(H,19,20,23)