5-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-1H-indole-2-carboxamide

Systemtic Name: 5-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-1H-indole-2-carboxamide Openeye Name: 5-methyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]-1H-indole-2-carboxamide CAS Name: 5-methyl-N-[4-(3-pyridinylmethylthio)phenyl]-1H-indole-2-carboxamide IUPAC Name: 5-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-1H-indole-2-carboxamide Traditional Name: 5-methyl-N-[4-(3-pyridylmethylthio)phenyl]-1H-indole-2-carboxamide Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C22H19N3OS/c1-15-4-9-20-17(11-15)12-21(25-20)22(26)24-18-5-7-19(8-6-18)27-14-16-3-2-10-23-13-16/h2-13,25H,14H2,1H3,(H,24,26)