1-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-3-(2-phenylsulfanylethyl)thiourea

Systemtic Name: 1-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-3-(2-phenylsulfanylethyl)thiourea Openeye Name: 1-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]-3-(2-phenylsulfanylethyl)thiourea CAS Name: 1-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]-3-[2-(phenylthio)ethyl]thiourea IUPAC Name: 1-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-3-(2-phenylsulfanylethyl)thiourea Traditional Name: 1-[2-(4-methoxyphenyl)-2-piperidino-ethyl]-3-[2-(phenylthio)ethyl]thiourea Formula: C23H31N3OS2 MolecularWeight: 429.64174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=S)NCCSC2=CC=CC=C2)N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=S)NCCSC2=CC=CC=C2)N3CCCCC3

InChI

InChI=1S/C23H31N3OS2/c1-27-20-12-10-19(11-13-20)22(26-15-6-3-7-16-26)18-25-23(28)24-14-17-29-21-8-4-2-5-9-21/h2,4-5,8-13,22H,3,6-7,14-18H2,1H3,(H2,24,25,28)