methyl 2-[2-(1-adamantyl)ethanoylamino]-5-[(2-methoxyphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(1-adamantyl)ethanoylamino]-5-[(2-methoxyphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(1-adamantyl)acetyl]amino]-5-[(2-methoxyphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(1-adamantyl)-1-oxoethyl]amino]-5-[(2-methoxyanilino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1-adamantyl)acetyl]amino]-5-[(2-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(1-adamantyl)acetyl]amino]-5-[(2-methoxyphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C27H32N2O5S MolecularWeight: 496.61838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CC23CC4CC(C2)CC(C4)C3)C(=O)NC5=CC=CC=C5OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CC23CC4CC(C2)CC(C4)C3)C(=O)NC5=CC=CC=C5OC

InChI

InChI=1S/C27H32N2O5S/c1-15-22(26(32)34-3)25(35-23(15)24(31)28-19-6-4-5-7-20(19)33-2)29-21(30)14-27-11-16-8-17(12-27)10-18(9-16)13-27/h4-7,16-18H,8-14H2,1-3H3,(H,28,31)(H,29,30)