2-(4-aminophenyl)sulfanyl-N-[1-(phenylmethyl)piperidin-4-yl]butanamide

Systemtic Name: 2-(4-aminophenyl)sulfanyl-N-[1-(phenylmethyl)piperidin-4-yl]butanamide Openeye Name: 2-(4-aminophenyl)sulfanyl-N-(1-benzyl-4-piperidyl)butanamide CAS Name: 2-[(4-aminophenyl)thio]-N-[1-(phenylmethyl)-4-piperidinyl]butanamide IUPAC Name: 2-(4-aminophenyl)sulfanyl-N-(1-benzylpiperidin-4-yl)butanamide Traditional Name: 2-[(4-aminophenyl)thio]-N-(1-benzyl-4-piperidyl)butyramide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CCN(CC1)CC2=CC=CC=C2)SC3=CC=C(C=C3)N

Isomeric SMILES

CCC(C(=O)NC1CCN(CC1)CC2=CC=CC=C2)SC3=CC=C(C=C3)N

InChI

InChI=1S/C22H29N3OS/c1-2-21(27-20-10-8-18(23)9-11-20)22(26)24-19-12-14-25(15-13-19)16-17-6-4-3-5-7-17/h3-11,19,21H,2,12-16,23H2,1H3,(H,24,26)