N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[4-[4-(3-acetamidopropyl)phenyl]-2-thiazolyl]-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C24H22N6O4S MolecularWeight: 490.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H22N6O4S/c1-16(31)25-12-3-4-17-7-9-18(10-8-17)22-15-35-24(26-22)27-23(32)21-11-13-29(28-21)19-5-2-6-20(14-19)30(33)34/h2,5-11,13-15H,3-4,12H2,1H3,(H,25,31)(H,26,27,32)