tert-butyl 3-[[4-[(4-dimethylaminophenyl)diazenyl]phenyl]sulfonylamino]-3H-indole-2-carboxylate

Systemtic Name: tert-butyl 3-[[4-[(4-dimethylaminophenyl)diazenyl]phenyl]sulfonylamino]-3H-indole-2-carboxylate Openeye Name: tert-butyl 3-[[4-(4-dimethylaminophenyl)azophenyl]sulfonylamino]-3H-indole-2-carboxylate CAS Name: 3-[[4-(4-dimethylaminophenyl)azophenyl]sulfonylamino]-3H-indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[4-[(4-dimethylaminophenyl)diazenyl]phenyl]sulfonylamino]-3H-indole-2-carboxylate Traditional Name: 3-[[4-(4-dimethylaminophenyl)azophenyl]sulfonylamino]-3H-indole-2-carboxylic acid tert-butyl ester Formula: C27H29N5O4S MolecularWeight: 519.61526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=NC2=CC=CC=C2C1NS(=O)(=O)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=NC2=CC=CC=C2C1NS(=O)(=O)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C27H29N5O4S/c1-27(2,3)36-26(33)25-24(22-8-6-7-9-23(22)28-25)31-37(34,35)21-16-12-19(13-17-21)30-29-18-10-14-20(15-11-18)32(4)5/h6-17,24,31H,1-5H3