1-(4-butylphenyl)-3-[(2,4,5-trimethoxyphenyl)carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(2,4,5-trimethoxyphenyl)carbonylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(2,4,5-trimethoxybenzoyl)amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[oxo-(2,4,5-trimethoxyphenyl)methyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(2,4,5-trimethoxybenzoyl)amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[(2,4,5-trimethoxybenzoyl)amino]thiourea Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=C(C=C2OC)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=C(C=C2OC)OC)OC

InChI

InChI=1S/C21H27N3O4S/c1-5-6-7-14-8-10-15(11-9-14)22-21(29)24-23-20(25)16-12-18(27-3)19(28-4)13-17(16)26-2/h8-13H,5-7H2,1-4H3,(H,23,25)(H2,22,24,29)