2-(2,4,6-trimethylphenyl)ethyl N-[(4-methyl-3-pyrrol-1-yl-thiophen-2-yl)carbonylamino]carbamate

Systemtic Name: 2-(2,4,6-trimethylphenyl)ethyl N-[(4-methyl-3-pyrrol-1-yl-thiophen-2-yl)carbonylamino]carbamate Openeye Name: 2-(2,4,6-trimethylphenyl)ethyl N-[(4-methyl-3-pyrrol-1-yl-thiophene-2-carbonyl)amino]carbamate CAS Name: N-[[[4-methyl-3-(1-pyrrolyl)-2-thiophenyl]-oxomethyl]amino]carbamic acid 2-(2,4,6-trimethylphenyl)ethyl ester IUPAC Name: 2-(2,4,6-trimethylphenyl)ethyl N-[(4-methyl-3-pyrrol-1-ylthiophene-2-carbonyl)amino]carbamate Traditional Name: N-[(4-methyl-3-pyrrol-1-yl-thiophene-2-carbonyl)amino]carbamic acid 2-mesitylethyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CCOC(=O)NNC(=O)C2=C(C(=CS2)C)N3C=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CCOC(=O)NNC(=O)C2=C(C(=CS2)C)N3C=CC=C3)C

InChI

InChI=1S/C22H25N3O3S/c1-14-11-15(2)18(16(3)12-14)7-10-28-22(27)24-23-21(26)20-19(17(4)13-29-20)25-8-5-6-9-25/h5-6,8-9,11-13H,7,10H2,1-4H3,(H,23,26)(H,24,27)