1-(2,3-dimethylphenyl)-3-[4-(2,5-dimethylpyrrol-1-yl)phenyl]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[4-(2,5-dimethylpyrrol-1-yl)phenyl]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[4-(2,5-dimethylpyrrol-1-yl)phenyl]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[4-(2,5-dimethylpyrrol-1-yl)phenyl]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[4-(2,5-dimethylpyrrol-1-yl)phenyl]thiourea Formula: C21H23N3S MolecularWeight: 349.49242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NC2=CC=C(C=C2)N3C(=CC=C3C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NC2=CC=C(C=C2)N3C(=CC=C3C)C)C

InChI

InChI=1S/C21H23N3S/c1-14-6-5-7-20(17(14)4)23-21(25)22-18-10-12-19(13-11-18)24-15(2)8-9-16(24)3/h5-13H,1-4H3,(H2,22,23,25)