3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[[4-(indolin-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[4-(indolin-1-ylmethyl)benzyl]propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)CC3=CC=C(C=C3)CNC(=O)CCSCC(=O)N

Isomeric SMILES

C1CN(C2=CC=CC=C21)CC3=CC=C(C=C3)CNC(=O)CCSCC(=O)N

InChI

InChI=1S/C21H25N3O2S/c22-20(25)15-27-12-10-21(26)23-13-16-5-7-17(8-6-16)14-24-11-9-18-3-1-2-4-19(18)24/h1-8H,9-15H2,(H2,22,25)(H,23,26)