[1-(4-nitrophenyl)pyrazol-4-yl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(4-nitrophenyl)pyrazol-4-yl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: [1-(4-nitrophenyl)pyrazol-4-yl]-[4-(3-thienylmethyl)piperazin-1-yl]methanone CAS Name: [1-(4-nitrophenyl)-4-pyrazolyl]-[4-(3-thiophenylmethyl)-1-piperazinyl]methanone IUPAC Name: [1-(4-nitrophenyl)pyrazol-4-yl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: [1-(4-nitrophenyl)pyrazol-4-yl]-[4-(3-thenyl)piperazino]methanone Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)C3=CN(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)C3=CN(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O3S/c25-19(22-8-6-21(7-9-22)12-15-5-10-28-14-15)16-11-20-23(13-16)17-1-3-18(4-2-17)24(26)27/h1-5,10-11,13-14H,6-9,12H2