methyl 4-(4-ethylphenyl)-2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-ethylphenyl)-2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-ethylphenyl)-2-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]thiophene-3-carboxylate CAS Name: 4-(4-ethylphenyl)-2-[[[2-[3-(1-methylethenyl)phenyl]propan-2-ylamino]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethylphenyl)-2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-ethylphenyl)-2-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)NC(C)(C)C3=CC=CC(=C3)C(=C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)NC(C)(C)C3=CC=CC(=C3)C(=C)C

InChI

InChI=1S/C27H30N2O3S/c1-7-18-11-13-19(14-12-18)22-16-33-24(23(22)25(30)32-6)28-26(31)29-27(4,5)21-10-8-9-20(15-21)17(2)3/h8-16H,2,7H2,1,3-6H3,(H2,28,29,31)