[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] (E)-3-(5-phenylthiophen-2-yl)prop-2-enoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] (E)-3-(5-phenylthiophen-2-yl)prop-2-enoate Openeye Name: (1-allophanoyl-2-methyl-propyl) (E)-3-(5-phenyl-2-thienyl)prop-2-enoate CAS Name: (E)-3-(5-phenyl-2-thiophenyl)-2-propenoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] (E)-3-(5-phenylthiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-phenyl-2-thienyl)acrylic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C=CC1=CC=C(S1)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)OC(=O)/C=C/C1=CC=C(S1)C2=CC=CC=C2

InChI

InChI=1S/C19H20N2O4S/c1-12(2)17(18(23)21-19(20)24)25-16(22)11-9-14-8-10-15(26-14)13-6-4-3-5-7-13/h3-12,17H,1-2H3,(H3,20,21,23,24)/b11-9+