N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]acetamide CAS Name: N-[4-[(2,6-dimethyl-4-pyrimidinyl)sulfamoyl]phenyl]-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]acetamide Traditional Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]thio]-N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]acetamide Formula: C23H23N7O3S3 MolecularWeight: 541.66882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NN=C(S3)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NN=C(S3)NCC4=CC=CC=C4

InChI

InChI=1S/C23H23N7O3S3/c1-15-12-20(26-16(2)25-15)30-36(32,33)19-10-8-18(9-11-19)27-21(31)14-34-23-29-28-22(35-23)24-13-17-6-4-3-5-7-17/h3-12H,13-14H2,1-2H3,(H,24,28)(H,27,31)(H,25,26,30)