5-[(3-aminocarbonylpiperidin-1-yl)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide

Systemtic Name: 5-[(3-aminocarbonylpiperidin-1-yl)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: 5-[(3-carbamoyl-1-piperidyl)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 5-[(3-carbamoyl-1-piperidinyl)methyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: 5-[(3-carbamoylpiperidin-1-yl)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: 5-[(3-carbamoylpiperidino)methyl]-3-(phenylthio)-1H-indole-2-carboxamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC3=C(C=C2)NC(=C3SC4=CC=CC=C4)C(=O)N)C(=O)N

Isomeric SMILES

C1CC(CN(C1)CC2=CC3=C(C=C2)NC(=C3SC4=CC=CC=C4)C(=O)N)C(=O)N

InChI

InChI=1S/C22H24N4O2S/c23-21(27)15-5-4-10-26(13-15)12-14-8-9-18-17(11-14)20(19(25-18)22(24)28)29-16-6-2-1-3-7-16/h1-3,6-9,11,15,25H,4-5,10,12-13H2,(H2,23,27)(H2,24,28)