(E)-1-[4-(3-nitro-4-phenylazanyl-phenyl)carbonylpiperazin-1-yl]-3-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-(3-nitro-4-phenylazanyl-phenyl)carbonylpiperazin-1-yl]-3-thiophen-2-yl-prop-2-en-1-one Openeye Name: (E)-1-[4-(4-anilino-3-nitro-benzoyl)piperazin-1-yl]-3-(2-thienyl)prop-2-en-1-one CAS Name: (E)-1-[4-[(4-anilino-3-nitrophenyl)-oxomethyl]-1-piperazinyl]-3-thiophen-2-yl-2-propen-1-one IUPAC Name: (E)-1-[4-(4-anilino-3-nitrobenzoyl)piperazin-1-yl]-3-thiophen-2-ylprop-2-en-1-one Traditional Name: (E)-1-[4-(4-anilino-3-nitro-benzoyl)piperazino]-3-(2-thienyl)prop-2-en-1-one Formula: C24H22N4O4S MolecularWeight: 462.52088

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC=CS2)C(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CC=CS2)C(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O4S/c29-23(11-9-20-7-4-16-33-20)26-12-14-27(15-13-26)24(30)18-8-10-21(22(17-18)28(31)32)25-19-5-2-1-3-6-19/h1-11,16-17,25H,12-15H2/b11-9+