ethyl 2-methyl-1-[3-[(3-methylsulfanylphenyl)carbamoyl]phenyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[3-[(3-methylsulfanylphenyl)carbamoyl]phenyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[3-[(3-methylsulfanylphenyl)carbamoyl]phenyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2-methyl-1-[3-[[3-(methylthio)anilino]-oxomethyl]phenyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[3-[(3-methylsulfanylphenyl)carbamoyl]phenyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 2-methyl-1-[3-[[3-(methylthio)phenyl]carbamoyl]phenyl]-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C28H26N2O3S MolecularWeight: 470.58264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)NC4=CC(=CC=C4)SC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)NC4=CC(=CC=C4)SC)C

InChI

InChI=1S/C28H26N2O3S/c1-4-33-28(32)25-18-26(20-10-6-5-7-11-20)30(19(25)2)23-14-8-12-21(16-23)27(31)29-22-13-9-15-24(17-22)34-3/h5-18H,4H2,1-3H3,(H,29,31)