1-(4-butylphenyl)-3-[2-(4-methanoyl-2-methoxy-phenoxy)ethanoylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[2-(4-methanoyl-2-methoxy-phenoxy)ethanoylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[2-(4-formyl-2-methoxy-phenoxy)acetyl]amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[2-(4-formyl-2-methoxyphenoxy)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[2-(4-formyl-2-methoxyphenoxy)acetyl]amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[[2-(4-formyl-2-methoxy-phenoxy)acetyl]amino]thiourea Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)COC2=C(C=C(C=C2)C=O)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)COC2=C(C=C(C=C2)C=O)OC

InChI

InChI=1S/C21H25N3O4S/c1-3-4-5-15-6-9-17(10-7-15)22-21(29)24-23-20(26)14-28-18-11-8-16(13-25)12-19(18)27-2/h6-13H,3-5,14H2,1-2H3,(H,23,26)(H2,22,24,29)