3-phenyl-1,1-bis[(4,7,7-trimethyl-3-oxidanylidene-2-bicyclo[2.2.1]heptanyl)methyl]thiourea

Systemtic Name: 3-phenyl-1,1-bis[(4,7,7-trimethyl-3-oxidanylidene-2-bicyclo[2.2.1]heptanyl)methyl]thiourea Openeye Name: 3-phenyl-1,1-bis[(4,7,7-trimethyl-3-oxo-norbornan-2-yl)methyl]thiourea CAS Name: 3-phenyl-1,1-bis[(4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanyl)methyl]thiourea IUPAC Name: 3-phenyl-1,1-bis[(4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanyl)methyl]thiourea Traditional Name: 1,1-bis[(3-keto-4,7,7-trimethyl-norbornan-2-yl)methyl]-3-phenyl-thiourea Formula: C29H40N2O2S MolecularWeight: 480.7051

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=O)C2CN(CC3C4CCC(C3=O)(C4(C)C)C)C(=S)NC5=CC=CC=C5)C)C

Isomeric SMILES

CC1(C2CCC1(C(=O)C2CN(CC3C4CCC(C3=O)(C4(C)C)C)C(=S)NC5=CC=CC=C5)C)C

InChI

InChI=1S/C29H40N2O2S/c1-26(2)21-12-14-28(26,5)23(32)19(21)16-31(25(34)30-18-10-8-7-9-11-18)17-20-22-13-15-29(6,24(20)33)27(22,3)4/h7-11,19-22H,12-17H2,1-6H3,(H,30,34)