1-(4-bromanyl-2,6-dimethyl-phenyl)-3-[(4-phenylmethoxyphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(4-bromanyl-2,6-dimethyl-phenyl)-3-[(4-phenylmethoxyphenyl)carbamothioylamino]thiourea Openeye Name: 1-(4-benzyloxyphenyl)-3-[(4-bromo-2,6-dimethyl-phenyl)carbamothioylamino]thiourea CAS Name: 1-[[(4-bromo-2,6-dimethylanilino)-sulfanylidenemethyl]amino]-3-(4-phenylmethoxyphenyl)thiourea IUPAC Name: 1-(4-bromo-2,6-dimethylphenyl)-3-[(4-phenylmethoxyphenyl)carbamothioylamino]thiourea Traditional Name: 1-(4-benzoxyphenyl)-3-[(4-bromo-2,6-dimethyl-phenyl)thiocarbamoylamino]thiourea Formula: C23H23BrN4OS2 MolecularWeight: 515.48892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=S)NNC(=S)NC2=CC=C(C=C2)OCC3=CC=CC=C3)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=S)NNC(=S)NC2=CC=C(C=C2)OCC3=CC=CC=C3)C)Br

InChI

InChI=1S/C23H23BrN4OS2/c1-15-12-18(24)13-16(2)21(15)26-23(31)28-27-22(30)25-19-8-10-20(11-9-19)29-14-17-6-4-3-5-7-17/h3-13H,14H2,1-2H3,(H2,25,27,30)(H2,26,28,31)