N-[1-[(2S)-2-azanyl-3-(1-benzothiophen-3-yl)propanoyl]piperidin-4-yl]-N-phenyl-propanamide

Systemtic Name: N-[1-[(2S)-2-azanyl-3-(1-benzothiophen-3-yl)propanoyl]piperidin-4-yl]-N-phenyl-propanamide Openeye Name: N-[1-[(2S)-2-amino-3-(benzothiophen-3-yl)propanoyl]-4-piperidyl]-N-phenyl-propanamide CAS Name: N-[1-[(2S)-2-amino-3-(1-benzothiophen-3-yl)-1-oxopropyl]-4-piperidinyl]-N-phenylpropanamide IUPAC Name: N-[1-[(2S)-2-amino-3-(1-benzothiophen-3-yl)propanoyl]piperidin-4-yl]-N-phenylpropanamide Traditional Name: N-[1-[(2S)-2-amino-3-(benzothiophen-3-yl)propanoyl]-4-piperidyl]-N-phenyl-propionamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CCN(CC1)C(=O)C(CC2=CSC3=CC=CC=C32)N)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)N(C1CCN(CC1)C(=O)[C@H](CC2=CSC3=CC=CC=C32)N)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2S/c1-2-24(29)28(19-8-4-3-5-9-19)20-12-14-27(15-13-20)25(30)22(26)16-18-17-31-23-11-7-6-10-21(18)23/h3-11,17,20,22H,2,12-16,26H2,1H3/t22-/m0/s1