2-[[3-(1-benzothiophen-3-yl)-2-(methylamino)propanoyl]-methyl-amino]-N-methyl-3-phenyl-propanamide

Systemtic Name: 2-[[3-(1-benzothiophen-3-yl)-2-(methylamino)propanoyl]-methyl-amino]-N-methyl-3-phenyl-propanamide Openeye Name: 2-[[3-(benzothiophen-3-yl)-2-(methylamino)propanoyl]-methyl-amino]-N-methyl-3-phenyl-propanamide CAS Name: 2-[[3-(1-benzothiophen-3-yl)-2-(methylamino)-1-oxopropyl]-methylamino]-N-methyl-3-phenylpropanamide IUPAC Name: 2-[[3-(1-benzothiophen-3-yl)-2-(methylamino)propanoyl]-methylamino]-N-methyl-3-phenylpropanamide Traditional Name: 2-[[3-(benzothiophen-3-yl)-2-(methylamino)propanoyl]-methyl-amino]-N-methyl-3-phenyl-propionamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CC1=CSC2=CC=CC=C21)C(=O)N(C)C(CC3=CC=CC=C3)C(=O)NC

Isomeric SMILES

CNC(CC1=CSC2=CC=CC=C21)C(=O)N(C)C(CC3=CC=CC=C3)C(=O)NC

InChI

InChI=1S/C23H27N3O2S/c1-24-19(14-17-15-29-21-12-8-7-11-18(17)21)23(28)26(3)20(22(27)25-2)13-16-9-5-4-6-10-16/h4-12,15,19-20,24H,13-14H2,1-3H3,(H,25,27)