methyl 2-[5-aminocarbonyl-9-(phenylmethyl)-2-thiophen-2-yl-carbazol-4-yl]oxyethanoate

Systemtic Name: methyl 2-[5-aminocarbonyl-9-(phenylmethyl)-2-thiophen-2-yl-carbazol-4-yl]oxyethanoate Openeye Name: methyl 2-[9-benzyl-5-carbamoyl-2-(2-thienyl)carbazol-4-yl]oxyacetate CAS Name: 2-[[5-carbamoyl-9-(phenylmethyl)-2-thiophen-2-yl-4-carbazolyl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-(9-benzyl-5-carbamoyl-2-thiophen-2-ylcarbazol-4-yl)oxyacetate Traditional Name: 2-[9-benzyl-5-carbamoyl-2-(2-thienyl)carbazol-4-yl]oxyacetic acid methyl ester Formula: C27H22N2O4S MolecularWeight: 470.53958

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC(=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC=C4)C(=O)N)C5=CC=CS5

Isomeric SMILES

COC(=O)COC1=CC(=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC=C4)C(=O)N)C5=CC=CS5

InChI

InChI=1S/C27H22N2O4S/c1-32-24(30)16-33-22-14-18(23-11-6-12-34-23)13-21-26(22)25-19(27(28)31)9-5-10-20(25)29(21)15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3,(H2,28,31)