3-cyclooctyl-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-(phenylmethyl)thiourea

Systemtic Name: 3-cyclooctyl-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-cyclooctyl-1-[(1-ethylpyrrolidin-2-yl)methyl]thiourea CAS Name: 3-cyclooctyl-1-[(1-ethyl-2-pyrrolidinyl)methyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-cyclooctyl-1-[(1-ethylpyrrolidin-2-yl)methyl]thiourea Traditional Name: 1-benzyl-3-cyclooctyl-1-[(1-ethylpyrrolidin-2-yl)methyl]thiourea Formula: C23H37N3S MolecularWeight: 387.62498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CN(CC2=CC=CC=C2)C(=S)NC3CCCCCCC3

Isomeric SMILES

CCN1CCCC1CN(CC2=CC=CC=C2)C(=S)NC3CCCCCCC3

InChI

InChI=1S/C23H37N3S/c1-2-25-17-11-16-22(25)19-26(18-20-12-7-6-8-13-20)23(27)24-21-14-9-4-3-5-10-15-21/h6-8,12-13,21-22H,2-5,9-11,14-19H2,1H3,(H,24,27)