(E)-2-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-3-thiophen-3-yl-prop-2-enenitrile

Systemtic Name: (E)-2-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-3-thiophen-3-yl-prop-2-enenitrile Openeye Name: (E)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-(3-thienyl)prop-2-enenitrile CAS Name: (E)-2-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-3-(3-thiophenyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-thiophen-3-ylprop-2-enenitrile Traditional Name: (E)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-(3-thienyl)acrylonitrile Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(=CC3=CSC=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)/C(=C/C3=CSC=C3)/C#N

InChI

InChI=1S/C18H16N4O3S/c19-12-15(11-14-5-10-26-13-14)18(23)21-8-6-20(7-9-21)16-1-3-17(4-2-16)22(24)25/h1-5,10-11,13H,6-9H2/b15-11+