5-chloranyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(3-methylphenyl)methylsulfonyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(3-methylphenyl)methylsulfonyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(m-tolylmethylsulfonyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(3-methylphenyl)methylsulfonyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(3-methylphenyl)methylsulfonyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(3-methylbenzyl)sulfonyl-pyrimidine-4-carboxamide Formula: C27H21ClN4O3S2 MolecularWeight: 549.06364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)C2=NC=C(C(=N2)C(=O)NC3=CC=C(C=C3)C4=NC5=C(S4)C=C(C=C5)C)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)C2=NC=C(C(=N2)C(=O)NC3=CC=C(C=C3)C4=NC5=C(S4)C=C(C=C5)C)Cl

InChI

InChI=1S/C27H21ClN4O3S2/c1-16-4-3-5-18(12-16)15-37(34,35)27-29-14-21(28)24(32-27)25(33)30-20-9-7-19(8-10-20)26-31-22-11-6-17(2)13-23(22)36-26/h3-14H,15H2,1-2H3,(H,30,33)