1-(4-butylphenyl)-3-[(4-ethoxy-3-methoxy-phenyl)carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(4-ethoxy-3-methoxy-phenyl)carbonylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(4-ethoxy-3-methoxy-benzoyl)amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[(4-ethoxy-3-methoxyphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(4-ethoxy-3-methoxybenzoyl)amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[(4-ethoxy-3-methoxy-benzoyl)amino]thiourea Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O3S/c1-4-6-7-15-8-11-17(12-9-15)22-21(28)24-23-20(25)16-10-13-18(27-5-2)19(14-16)26-3/h8-14H,4-7H2,1-3H3,(H,23,25)(H2,22,24,28)