3-cyclooctyl-1-(2-methylpropyl)-1-(1-phenylethyl)thiourea

Systemtic Name: 3-cyclooctyl-1-(2-methylpropyl)-1-(1-phenylethyl)thiourea Openeye Name: 3-cyclooctyl-1-isobutyl-1-(1-phenylethyl)thiourea CAS Name: 3-cyclooctyl-1-(2-methylpropyl)-1-(1-phenylethyl)thiourea IUPAC Name: 3-cyclooctyl-1-(2-methylpropyl)-1-(1-phenylethyl)thiourea Traditional Name: 3-cyclooctyl-1-isobutyl-1-(1-phenylethyl)thiourea Formula: C21H34N2S MolecularWeight: 346.57306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C(C)C1=CC=CC=C1)C(=S)NC2CCCCCCC2

Isomeric SMILES

CC(C)CN(C(C)C1=CC=CC=C1)C(=S)NC2CCCCCCC2

InChI

InChI=1S/C21H34N2S/c1-17(2)16-23(18(3)19-12-8-7-9-13-19)21(24)22-20-14-10-5-4-6-11-15-20/h7-9,12-13,17-18,20H,4-6,10-11,14-16H2,1-3H3,(H,22,24)