1-cyclohexyl-3-[4-[(cyclohexylcarbamothioylamino)carbamoyl]phenyl]thiourea

Systemtic Name: 1-cyclohexyl-3-[4-[(cyclohexylcarbamothioylamino)carbamoyl]phenyl]thiourea Openeye Name: 1-cyclohexyl-3-[[4-(cyclohexylcarbamothioylamino)benzoyl]amino]thiourea CAS Name: 1-cyclohexyl-3-[[[4-[[(cyclohexylamino)-sulfanylidenemethyl]amino]phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-cyclohexyl-3-[[4-(cyclohexylcarbamothioylamino)benzoyl]amino]thiourea Traditional Name: 1-cyclohexyl-3-[[4-(cyclohexylthiocarbamoylamino)benzoyl]amino]thiourea Formula: C21H31N5OS2 MolecularWeight: 433.63374

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3CCCCC3

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3CCCCC3

InChI

InChI=1S/C21H31N5OS2/c27-19(25-26-21(29)24-17-9-5-2-6-10-17)15-11-13-18(14-12-15)23-20(28)22-16-7-3-1-4-8-16/h11-14,16-17H,1-10H2,(H,25,27)(H2,22,23,28)(H2,24,26,29)