1-(4-tert-butylphenyl)-3-[6-[(4-tert-butylphenyl)carbamothioylamino]hexyl]thiourea

Systemtic Name: 1-(4-tert-butylphenyl)-3-[6-[(4-tert-butylphenyl)carbamothioylamino]hexyl]thiourea Openeye Name: 1-(4-tert-butylphenyl)-3-[6-[(4-tert-butylphenyl)carbamothioylamino]hexyl]thiourea CAS Name: 1-[6-[[(4-tert-butylanilino)-sulfanylidenemethyl]amino]hexyl]-3-(4-tert-butylphenyl)thiourea IUPAC Name: 1-(4-tert-butylphenyl)-3-[6-[(4-tert-butylphenyl)carbamothioylamino]hexyl]thiourea Traditional Name: 1-(4-tert-butylphenyl)-3-[6-[(4-tert-butylphenyl)thiocarbamoylamino]hexyl]thiourea Formula: C28H42N4S2 MolecularWeight: 498.78988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=S)NCCCCCCNC(=S)NC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=S)NCCCCCCNC(=S)NC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C28H42N4S2/c1-27(2,3)21-11-15-23(16-12-21)31-25(33)29-19-9-7-8-10-20-30-26(34)32-24-17-13-22(14-18-24)28(4,5)6/h11-18H,7-10,19-20H2,1-6H3,(H2,29,31,33)(H2,30,32,34)