[4-[3-(aminomethyl)phenyl]piperidin-1-yl]-(3-methylsulfanyl-6,7-dihydro-2-benzothiophen-1-yl)methanone

Systemtic Name: [4-[3-(aminomethyl)phenyl]piperidin-1-yl]-(3-methylsulfanyl-6,7-dihydro-2-benzothiophen-1-yl)methanone Openeye Name: [4-[3-(aminomethyl)phenyl]-1-piperidyl]-(3-methylsulfanyl-6,7-dihydro-2-benzothiophen-1-yl)methanone CAS Name: [4-[3-(aminomethyl)phenyl]-1-piperidinyl]-[3-(methylthio)-6,7-dihydro-2-benzothiophen-1-yl]methanone IUPAC Name: [4-[3-(aminomethyl)phenyl]piperidin-1-yl]-(3-methylsulfanyl-6,7-dihydro-2-benzothiophen-1-yl)methanone Traditional Name: [4-[3-(aminomethyl)phenyl]piperidino]-[3-(methylthio)-6,7-dihydroisobenzothiophen-1-yl]methanone Formula: C22H26N2OS2 MolecularWeight: 398.58464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C2C=CCCC2=C(S1)C(=O)N3CCC(CC3)C4=CC(=CC=C4)CN

Isomeric SMILES

CSC1=C2C=CCCC2=C(S1)C(=O)N3CCC(CC3)C4=CC(=CC=C4)CN

InChI

InChI=1S/C22H26N2OS2/c1-26-22-19-8-3-2-7-18(19)20(27-22)21(25)24-11-9-16(10-12-24)17-6-4-5-15(13-17)14-23/h3-6,8,13,16H,2,7,9-12,14,23H2,1H3