1-[(2,2-dimethyl-1,3-benzodithiol-4-yl)sulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea

Systemtic Name: 1-[(2,2-dimethyl-1,3-benzodithiol-4-yl)sulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea Openeye Name: 1-[(2,2-dimethyl-1,3-benzodithiol-4-yl)sulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea CAS Name: 1-[(2,2-dimethyl-1,3-benzodithiol-4-yl)sulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea IUPAC Name: 1-[(2,2-dimethyl-1,3-benzodithiol-4-yl)sulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea Traditional Name: 1-[(2,2-dimethyl-1,3-benzodithiol-4-yl)sulfonyl]-3-(4-methoxy-6-methyl-s-triazin-2-yl)urea Formula: C15H17N5O4S3 MolecularWeight: 427.52158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC3=C2SC(S3)(C)C

Isomeric SMILES

CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC3=C2SC(S3)(C)C

InChI

InChI=1S/C15H17N5O4S3/c1-8-16-12(19-14(17-8)24-4)18-13(21)20-27(22,23)10-7-5-6-9-11(10)26-15(2,3)25-9/h5-7H,1-4H3,(H2,16,17,18,19,20,21)