tert-butyl 2-[2-(1,2-benzothiazol-3-ylamino)ethylcarbamoyl]-2,3-dihydroindole-1-carboxylate

Systemtic Name: tert-butyl 2-[2-(1,2-benzothiazol-3-ylamino)ethylcarbamoyl]-2,3-dihydroindole-1-carboxylate Openeye Name: tert-butyl 2-[2-(1,2-benzothiazol-3-ylamino)ethylcarbamoyl]indoline-1-carboxylate CAS Name: 2-[[2-(1,2-benzothiazol-3-ylamino)ethylamino]-oxomethyl]-2,3-dihydroindole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-(1,2-benzothiazol-3-ylamino)ethylcarbamoyl]-2,3-dihydroindole-1-carboxylate Traditional Name: 2-[2-(1,2-benzothiazol-3-ylamino)ethylcarbamoyl]indoline-1-carboxylic acid tert-butyl ester Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CC2=CC=CC=C21)C(=O)NCCNC3=NSC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)N1C(CC2=CC=CC=C21)C(=O)NCCNC3=NSC4=CC=CC=C43

InChI

InChI=1S/C23H26N4O3S/c1-23(2,3)30-22(29)27-17-10-6-4-8-15(17)14-18(27)21(28)25-13-12-24-20-16-9-5-7-11-19(16)31-26-20/h4-11,18H,12-14H2,1-3H3,(H,24,26)(H,25,28)