1-(3-ethanoylphenyl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea

Systemtic Name: 1-(3-ethanoylphenyl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea Openeye Name: 1-(3-acetylphenyl)-3-[4-(p-tolylsulfonylamino)phenyl]thiourea CAS Name: 1-(3-acetylphenyl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea IUPAC Name: 1-(3-acetylphenyl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea Traditional Name: 1-(3-acetylphenyl)-3-[4-(tosylamino)phenyl]thiourea Formula: C22H21N3O3S2 MolecularWeight: 439.55044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H21N3O3S2/c1-15-6-12-21(13-7-15)30(27,28)25-19-10-8-18(9-11-19)23-22(29)24-20-5-3-4-17(14-20)16(2)26/h3-14,25H,1-2H3,(H2,23,24,29)