1-(1,3-benzothiazol-2-yl)-3-[1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-[1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-[1-(3,4-dimethylphenyl)-5-oxo-pyrrolidin-3-yl]urea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-[1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinyl]urea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]urea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-[1-(3,4-dimethylphenyl)-5-keto-pyrrolidin-3-yl]urea Formula: C20H20N4O2S MolecularWeight: 380.4634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)NC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)NC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C20H20N4O2S/c1-12-7-8-15(9-13(12)2)24-11-14(10-18(24)25)21-19(26)23-20-22-16-5-3-4-6-17(16)27-20/h3-9,14H,10-11H2,1-2H3,(H2,21,22,23,26)