N-[(3-aminophenyl)methyl]-5-chloranyl-3-(phenylsulfonyl)-1H-indole-2-carboxamide

Systemtic Name: N-[(3-aminophenyl)methyl]-5-chloranyl-3-(phenylsulfonyl)-1H-indole-2-carboxamide Openeye Name: N-[(3-aminophenyl)methyl]-3-(benzenesulfonyl)-5-chloro-1H-indole-2-carboxamide CAS Name: N-[(3-aminophenyl)methyl]-3-(benzenesulfonyl)-5-chloro-1H-indole-2-carboxamide IUPAC Name: N-[(3-aminophenyl)methyl]-3-(benzenesulfonyl)-5-chloro-1H-indole-2-carboxamide Traditional Name: N-(3-aminobenzyl)-3-besyl-5-chloro-1H-indole-2-carboxamide Formula: C22H18ClN3O3S MolecularWeight: 439.91462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)C(=O)NCC4=CC(=CC=C4)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)C(=O)NCC4=CC(=CC=C4)N

InChI

InChI=1S/C22H18ClN3O3S/c23-15-9-10-19-18(12-15)21(30(28,29)17-7-2-1-3-8-17)20(26-19)22(27)25-13-14-5-4-6-16(24)11-14/h1-12,26H,13,24H2,(H,25,27)