N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-3-phenylsulfanyl-propanamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-3-phenylsulfanyl-propanamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-3-phenylsulfanyl-propanamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-3-(phenylthio)propanamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-3-phenylsulfanylpropanamide Traditional Name: N-[4-(4-ethylpiperazino)-2-methyl-phenyl]-3-(phenylthio)propionamide Formula: C22H29N3OS MolecularWeight: 383.55016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CCSC3=CC=CC=C3)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CCSC3=CC=CC=C3)C

InChI

InChI=1S/C22H29N3OS/c1-3-24-12-14-25(15-13-24)19-9-10-21(18(2)17-19)23-22(26)11-16-27-20-7-5-4-6-8-20/h4-10,17H,3,11-16H2,1-2H3,(H,23,26)