N-[(E)-[(E)-1,3-dithiophen-2-ylprop-2-enylidene]amino]-3,4-dinitro-aniline

Systemtic Name: N-[(E)-[(E)-1,3-dithiophen-2-ylprop-2-enylidene]amino]-3,4-dinitro-aniline Openeye Name: N-[(E)-[(E)-1,3-bis(2-thienyl)prop-2-enylidene]amino]-3,4-dinitro-aniline CAS Name: N-[(E)-[(E)-1,3-dithiophen-2-ylprop-2-enylidene]amino]-3,4-dinitroaniline IUPAC Name: N-[(E)-[(E)-1,3-dithiophen-2-ylprop-2-enylidene]amino]-3,4-dinitroaniline Traditional Name: [(E)-[(E)-1,3-bis(2-thienyl)prop-2-enylidene]amino]-(3,4-dinitrophenyl)amine Formula: C17H12N4O4S2 MolecularWeight: 400.43158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC(=NNC2=CC(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

C1=CSC(=C1)/C=C/C(=N\NC2=CC(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])/C3=CC=CS3

InChI

InChI=1S/C17H12N4O4S2/c22-20(23)15-8-5-12(11-16(15)21(24)25)18-19-14(17-4-2-10-27-17)7-6-13-3-1-9-26-13/h1-11,18H/b7-6+,19-14+