methyl 2-[2-[cyclohexyl(methyl)amino]ethanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[cyclohexyl(methyl)amino]ethanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[cyclohexyl(methyl)amino]acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[2-[cyclohexyl(methyl)amino]-1-oxoethyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[cyclohexyl(methyl)amino]acetyl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-[cyclohexyl(methyl)amino]acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CN(C)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CN(C)C3CCCCC3

InChI

InChI=1S/C22H28N2O3S/c1-15-9-11-16(12-10-15)18-14-28-21(20(18)22(26)27-3)23-19(25)13-24(2)17-7-5-4-6-8-17/h9-12,14,17H,4-8,13H2,1-3H3,(H,23,25)