1-phenyl-3-[[3-[(phenylcarbamothioylamino)methyl]cyclohexyl]methyl]thiourea

Systemtic Name: 1-phenyl-3-[[3-[(phenylcarbamothioylamino)methyl]cyclohexyl]methyl]thiourea Openeye Name: 1-phenyl-3-[[3-[(phenylcarbamothioylamino)methyl]cyclohexyl]methyl]thiourea CAS Name: 1-[[3-[[[anilino(sulfanylidene)methyl]amino]methyl]cyclohexyl]methyl]-3-phenylthiourea IUPAC Name: 1-phenyl-3-[[3-[(phenylcarbamothioylamino)methyl]cyclohexyl]methyl]thiourea Traditional Name: 1-phenyl-3-[[3-[(phenylthiocarbamoylamino)methyl]cyclohexyl]methyl]thiourea Formula: C22H28N4S2 MolecularWeight: 412.61452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CNC(=S)NC2=CC=CC=C2)CNC(=S)NC3=CC=CC=C3

Isomeric SMILES

C1CC(CC(C1)CNC(=S)NC2=CC=CC=C2)CNC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C22H28N4S2/c27-21(25-19-10-3-1-4-11-19)23-15-17-8-7-9-18(14-17)16-24-22(28)26-20-12-5-2-6-13-20/h1-6,10-13,17-18H,7-9,14-16H2,(H2,23,25,27)(H2,24,26,28)