ethyl 2-[2-[bis(prop-2-enyl)amino]ethanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[bis(prop-2-enyl)amino]ethanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(diallylamino)acetyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[bis(prop-2-enyl)amino]-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[bis(prop-2-enyl)amino]acetyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(diallylamino)acetyl]amino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CN(CC=C)CC=C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CN(CC=C)CC=C

InChI

InChI=1S/C21H24N2O3S/c1-4-12-23(13-5-2)15-19(24)22-20-17(21(25)26-6-3)14-18(27-20)16-10-8-7-9-11-16/h4-5,7-11,14H,1-2,6,12-13,15H2,3H3,(H,22,24)