N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-phenyl-butanamide

Systemtic Name: N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-phenyl-butanamide Openeye Name: N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-phenyl-butanamide CAS Name: N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-phenylbutanamide IUPAC Name: N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-phenylbutanamide Traditional Name: N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-phenyl-butyramide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(N(N=C2CS1)C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1C2=C(N(N=C2CS1)C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C21H20N4O3S/c26-20(8-4-7-15-5-2-1-3-6-15)22-21-18-13-29-14-19(18)23-24(21)16-9-11-17(12-10-16)25(27)28/h1-3,5-6,9-12H,4,7-8,13-14H2,(H,22,26)