[2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate

Systemtic Name: [2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate Openeye Name: [2-(dibenzylamino)-2-oxo-ethyl] (Z)-2,3-bis(2-thienyl)prop-2-enoate CAS Name: (Z)-2,3-dithiophen-2-yl-2-propenoic acid [2-[bis(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-(dibenzylamino)-2-oxoethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate Traditional Name: (Z)-2,3-bis(2-thienyl)acrylic acid [2-(dibenzylamino)-2-keto-ethyl] ester Formula: C27H23NO3S2 MolecularWeight: 473.60642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)COC(=O)C(=CC3=CC=CS3)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)COC(=O)/C(=C/C3=CC=CS3)/C4=CC=CS4

InChI

InChI=1S/C27H23NO3S2/c29-26(28(18-21-9-3-1-4-10-21)19-22-11-5-2-6-12-22)20-31-27(30)24(25-14-8-16-33-25)17-23-13-7-15-32-23/h1-17H,18-20H2/b24-17+