[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2,3-dithiophen-2-ylprop-2-enoate

Systemtic Name: [2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2,3-dithiophen-2-ylprop-2-enoate Openeye Name: [2-(4-butylanilino)-2-oxo-ethyl] 2,3-bis(2-thienyl)prop-2-enoate CAS Name: 2,3-dithiophen-2-yl-2-propenoic acid [2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butylanilino)-2-oxoethyl] 2,3-dithiophen-2-ylprop-2-enoate Traditional Name: 2,3-bis(2-thienyl)acrylic acid [2-(4-butylanilino)-2-keto-ethyl] ester Formula: C23H23NO3S2 MolecularWeight: 425.56362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C(=CC2=CC=CS2)C3=CC=CS3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C(=CC2=CC=CS2)C3=CC=CS3

InChI

InChI=1S/C23H23NO3S2/c1-2-3-6-17-9-11-18(12-10-17)24-22(25)16-27-23(26)20(21-8-5-14-29-21)15-19-7-4-13-28-19/h4-5,7-15H,2-3,6,16H2,1H3,(H,24,25)