5-chloranyl-N-[(3-hydroxyphenyl)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-N-[(3-hydroxyphenyl)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: 5-chloro-N-[(3-hydroxyphenyl)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 5-chloro-N-[(3-hydroxyphenyl)methyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: 5-chloro-N-[(3-hydroxyphenyl)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: 5-chloro-N-(3-hydroxybenzyl)-3-(phenylthio)-1H-indole-2-carboxamide Formula: C22H17ClN2O2S MolecularWeight: 408.90058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(NC3=C2C=C(C=C3)Cl)C(=O)NCC4=CC(=CC=C4)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(NC3=C2C=C(C=C3)Cl)C(=O)NCC4=CC(=CC=C4)O

InChI

InChI=1S/C22H17ClN2O2S/c23-15-9-10-19-18(12-15)21(28-17-7-2-1-3-8-17)20(25-19)22(27)24-13-14-5-4-6-16(26)11-14/h1-12,25-26H,13H2,(H,24,27)