[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] (Z)-2,3-bis(2-thienyl)prop-2-enoate CAS Name: (Z)-2,3-dithiophen-2-yl-2-propenoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate Traditional Name: (Z)-2,3-bis(2-thienyl)acrylic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C(=CC1=CC=CS1)C2=CC=CS2

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)/C(=C/C1=CC=CS1)/C2=CC=CS2

InChI

InChI=1S/C19H22N2O4S2/c1-13(2)7-8-20-19(24)21-17(22)12-25-18(23)15(16-6-4-10-27-16)11-14-5-3-9-26-14/h3-6,9-11,13H,7-8,12H2,1-2H3,(H2,20,21,22,24)/b15-11+