N-[5-[(4-dimethylaminophenyl)methylcarbamoyl]-2-methyl-phenyl]-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[5-[(4-dimethylaminophenyl)methylcarbamoyl]-2-methyl-phenyl]-1,2-benzothiazole-3-carboxamide Openeye Name: N-[5-[(4-dimethylaminophenyl)methylcarbamoyl]-2-methyl-phenyl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[5-[[(4-dimethylaminophenyl)methylamino]-oxomethyl]-2-methylphenyl]-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[5-[(4-dimethylaminophenyl)methylcarbamoyl]-2-methylphenyl]-1,2-benzothiazole-3-carboxamide Traditional Name: N-[5-[[4-(dimethylamino)benzyl]carbamoyl]-2-methyl-phenyl]-1,2-benzothiazole-3-carboxamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)N(C)C)NC(=O)C3=NSC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)N(C)C)NC(=O)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C25H24N4O2S/c1-16-8-11-18(24(30)26-15-17-9-12-19(13-10-17)29(2)3)14-21(16)27-25(31)23-20-6-4-5-7-22(20)32-28-23/h4-14H,15H2,1-3H3,(H,26,30)(H,27,31)