1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-[(2-methyl-5-nitro-phenyl)amino]ethanone

Systemtic Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-[(2-methyl-5-nitro-phenyl)amino]ethanone Openeye Name: 1-[3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-(2-methyl-5-nitro-anilino)ethanone CAS Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-(2-methyl-5-nitroanilino)ethanone IUPAC Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-(2-methyl-5-nitroanilino)ethanone Traditional Name: 1-[3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-2-(2-methyl-5-nitro-anilino)ethanone Formula: C20H18N4O3S2 MolecularWeight: 426.51192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C20H18N4O3S2/c1-13-6-7-14(24(26)27)10-15(13)21-12-20(25)23-17(19-5-3-9-29-19)11-16(22-23)18-4-2-8-28-18/h2-10,17,21H,11-12H2,1H3