ethyl 4-[4-[(2S)-butan-2-yl]phenyl]-5-methyl-2-[(4-methylphenyl)carbamoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-[4-[(2S)-butan-2-yl]phenyl]-5-methyl-2-[(4-methylphenyl)carbamoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-methyl-4-[4-[(1S)-1-methylpropyl]phenyl]-2-(p-tolylcarbamoylamino)thiophene-3-carboxylate CAS Name: 4-[4-[(2S)-butan-2-yl]phenyl]-5-methyl-2-[[(4-methylanilino)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2S)-butan-2-yl]phenyl]-5-methyl-2-[(4-methylphenyl)carbamoylamino]thiophene-3-carboxylate Traditional Name: 5-methyl-4-[4-[(1S)-1-methylpropyl]phenyl]-2-(p-tolylcarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C26H30N2O3S MolecularWeight: 450.593

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCC)NC(=O)NC3=CC=C(C=C3)C)C

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCC)NC(=O)NC3=CC=C(C=C3)C)C

InChI

InChI=1S/C26H30N2O3S/c1-6-17(4)19-10-12-20(13-11-19)22-18(5)32-24(23(22)25(29)31-7-2)28-26(30)27-21-14-8-16(3)9-15-21/h8-15,17H,6-7H2,1-5H3,(H2,27,28,30)/t17-/m0/s1