methyl 4,5-dimethyl-2-[2-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[2-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[(4-allyloxyphenyl)methyl-methyl-amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[2-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[(4-allyloxybenzyl)-methyl-amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN(C)CC2=CC=C(C=C2)OCC=C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN(C)CC2=CC=C(C=C2)OCC=C)C

InChI

InChI=1S/C21H26N2O4S/c1-6-11-27-17-9-7-16(8-10-17)12-23(4)13-18(24)22-20-19(21(25)26-5)14(2)15(3)28-20/h6-10H,1,11-13H2,2-5H3,(H,22,24)