1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-prop-2-enyl-urea

Systemtic Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-prop-2-enyl-urea Openeye Name: 1-allyl-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)urea CAS Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-prop-2-enylurea IUPAC Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-prop-2-enylurea Traditional Name: 1-allyl-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)urea Formula: C13H15N3OS MolecularWeight: 261.3427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)NCC=C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)NCC=C

InChI

InChI=1S/C13H15N3OS/c1-4-5-14-12(17)16-13-15-10-6-8(2)9(3)7-11(10)18-13/h4,6-7H,1,5H2,2-3H3,(H2,14,15,16,17)