1-(4-butylphenyl)-3-[2-[(2-methoxyphenyl)amino]ethanoylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[2-[(2-methoxyphenyl)amino]ethanoylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[2-(2-methoxyanilino)acetyl]amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[2-(2-methoxyanilino)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[2-(2-methoxyanilino)acetyl]amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[[2-(o-anisidino)acetyl]amino]thiourea Formula: C20H26N4O2S MolecularWeight: 386.51104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CNC2=CC=CC=C2OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CNC2=CC=CC=C2OC

InChI

InChI=1S/C20H26N4O2S/c1-3-4-7-15-10-12-16(13-11-15)22-20(27)24-23-19(25)14-21-17-8-5-6-9-18(17)26-2/h5-6,8-13,21H,3-4,7,14H2,1-2H3,(H,23,25)(H2,22,24,27)