2-(6-methylpyrimidin-4-yl)sulfanyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 2-(6-methylpyrimidin-4-yl)sulfanyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 2-(6-methylpyrimidin-4-yl)sulfanyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 2-[(6-methyl-4-pyrimidinyl)thio]-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 2-(6-methylpyrimidin-4-yl)sulfanyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 2-[(6-methylpyrimidin-4-yl)thio]-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propionamide Formula: C15H15N5O3S3 MolecularWeight: 409.5063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)SC(C)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=NC=N1)SC(C)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C15H15N5O3S3/c1-8-5-13(18-7-17-8)24-9(2)14(21)20-15-19-11-4-3-10(26(16,22)23)6-12(11)25-15/h3-7,9H,1-2H3,(H2,16,22,23)(H,19,20,21)