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

Systemtic Name: 3-phenylsulfanyl-5-[(propan-2-ylamino)methyl]-1H-indole-2-carboxamide Openeye Name: 5-[(isopropylamino)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 3-(phenylthio)-5-[(propan-2-ylamino)methyl]-1H-indole-2-carboxamide IUPAC Name: 3-phenylsulfanyl-5-[(propan-2-ylamino)methyl]-1H-indole-2-carboxamide Traditional Name: 5-[(isopropylamino)methyl]-3-(phenylthio)-1H-indole-2-carboxamide Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3OS/c1-12(2)21-11-13-8-9-16-15(10-13)18(17(22-16)19(20)23)24-14-6-4-3-5-7-14/h3-10,12,21-22H,11H2,1-2H3,(H2,20,23)