5-[[5-chloranyl-2-[(4-sulfamoylphenyl)amino]pyrimidin-4-yl]amino]-N-cyclopropyl-indole-1-carboxamide

Systemtic Name: 5-[[5-chloranyl-2-[(4-sulfamoylphenyl)amino]pyrimidin-4-yl]amino]-N-cyclopropyl-indole-1-carboxamide Openeye Name: 5-[[5-chloro-2-(4-sulfamoylanilino)pyrimidin-4-yl]amino]-N-cyclopropyl-indole-1-carboxamide CAS Name: 5-[[5-chloro-2-(4-sulfamoylanilino)-4-pyrimidinyl]amino]-N-cyclopropyl-1-indolecarboxamide IUPAC Name: 5-[[5-chloro-2-(4-sulfamoylanilino)pyrimidin-4-yl]amino]-N-cyclopropylindole-1-carboxamide Traditional Name: 5-[[5-chloro-2-(4-sulfamoylanilino)pyrimidin-4-yl]amino]-N-cyclopropyl-indole-1-carboxamide Formula: C22H20ClN7O3S MolecularWeight: 497.9573

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)N2C=CC3=C2C=CC(=C3)NC4=NC(=NC=C4Cl)NC5=CC=C(C=C5)S(=O)(=O)N

Isomeric SMILES

C1CC1NC(=O)N2C=CC3=C2C=CC(=C3)NC4=NC(=NC=C4Cl)NC5=CC=C(C=C5)S(=O)(=O)N

InChI

InChI=1S/C22H20ClN7O3S/c23-18-12-25-21(27-14-3-6-17(7-4-14)34(24,32)33)29-20(18)26-16-5-8-19-13(11-16)9-10-30(19)22(31)28-15-1-2-15/h3-12,15H,1-2H2,(H,28,31)(H2,24,32,33)(H2,25,26,27,29)