5-[(1-oxidanylpropan-2-ylamino)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide

Systemtic Name: 5-[(1-oxidanylpropan-2-ylamino)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: 5-[[(2-hydroxy-1-methyl-ethyl)amino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 5-[(1-hydroxypropan-2-ylamino)methyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: 5-[(1-hydroxypropan-2-ylamino)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: 5-[[(2-hydroxy-1-methyl-ethyl)amino]methyl]-3-(phenylthio)-1H-indole-2-carboxamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NCC1=CC2=C(C=C1)NC(=C2SC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC(CO)NCC1=CC2=C(C=C1)NC(=C2SC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C19H21N3O2S/c1-12(11-23)21-10-13-7-8-16-15(9-13)18(17(22-16)19(20)24)25-14-5-3-2-4-6-14/h2-9,12,21-23H,10-11H2,1H3,(H2,20,24)