(E)-3-(5-methylthiophen-2-yl)-1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(5-methylthiophen-2-yl)-1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(5-methyl-2-thienyl)-1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(5-methyl-2-thiophenyl)-1-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(5-methylthiophen-2-yl)-1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(5-methyl-2-thienyl)-1-[4-(5-nitrothiophene-2-carbonyl)piperazino]prop-2-en-1-one Formula: C17H17N3O4S2 MolecularWeight: 391.46458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O4S2/c1-12-2-3-13(25-12)4-6-15(21)18-8-10-19(11-9-18)17(22)14-5-7-16(26-14)20(23)24/h2-7H,8-11H2,1H3/b6-4+