ethyl 1-ethyl-2-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxo-ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-[(9-ethyl-3-carbazolyl)amino]-2-oxoethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[[2-[(9-ethylcarbazol-3-yl)amino]-2-keto-ethyl]thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C28H28N4O3S MolecularWeight: 500.61192

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)CSC3=NC4=C(N3CC)C=CC(=C4)C(=O)OCC)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)CSC3=NC4=C(N3CC)C=CC(=C4)C(=O)OCC)C5=CC=CC=C51

InChI

InChI=1S/C28H28N4O3S/c1-4-31-23-10-8-7-9-20(23)21-16-19(12-14-24(21)31)29-26(33)17-36-28-30-22-15-18(27(34)35-6-3)11-13-25(22)32(28)5-2/h7-16H,4-6,17H2,1-3H3,(H,29,33)