3-[2-(4-chlorophenyl)ethyl]-1-ethyl-1-[1-(phenylmethyl)pyrrolidin-3-yl]thiourea

Systemtic Name: 3-[2-(4-chlorophenyl)ethyl]-1-ethyl-1-[1-(phenylmethyl)pyrrolidin-3-yl]thiourea Openeye Name: 1-(1-benzylpyrrolidin-3-yl)-3-[2-(4-chlorophenyl)ethyl]-1-ethyl-thiourea CAS Name: 3-[2-(4-chlorophenyl)ethyl]-1-ethyl-1-[1-(phenylmethyl)-3-pyrrolidinyl]thiourea IUPAC Name: 1-(1-benzylpyrrolidin-3-yl)-3-[2-(4-chlorophenyl)ethyl]-1-ethylthiourea Traditional Name: 1-(1-benzylpyrrolidin-3-yl)-3-[2-(4-chlorophenyl)ethyl]-1-ethyl-thiourea Formula: C22H28ClN3S MolecularWeight: 401.99582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(C1)CC2=CC=CC=C2)C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN(C1CCN(C1)CC2=CC=CC=C2)C(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H28ClN3S/c1-2-26(22(27)24-14-12-18-8-10-20(23)11-9-18)21-13-15-25(17-21)16-19-6-4-3-5-7-19/h3-11,21H,2,12-17H2,1H3,(H,24,27)