[2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-ethyl] 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-ethyl] 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate Openeye Name: [2-[(9-ethylcarbazol-3-yl)amino]-2-oxo-ethyl] 3,6-dichlorobenzothiophene-2-carboxylate CAS Name: 3,6-dichloro-1-benzothiophene-2-carboxylic acid [2-[(9-ethyl-3-carbazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl] 3,6-dichloro-1-benzothiophene-2-carboxylate Traditional Name: 3,6-dichlorobenzothiophene-2-carboxylic acid [2-[(9-ethylcarbazol-3-yl)amino]-2-keto-ethyl] ester Formula: C25H18Cl2N2O3S MolecularWeight: 497.39302

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)COC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)COC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl)C5=CC=CC=C51

InChI

InChI=1S/C25H18Cl2N2O3S/c1-2-29-19-6-4-3-5-16(19)18-12-15(8-10-20(18)29)28-22(30)13-32-25(31)24-23(27)17-9-7-14(26)11-21(17)33-24/h3-12H,2,13H2,1H3,(H,28,30)