N-[3-[1,3-benzothiazol-2-ylmethyl(methyl)carbamoyl]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[3-[1,3-benzothiazol-2-ylmethyl(methyl)carbamoyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[3-[1,3-benzothiazol-2-ylmethyl(methyl)carbamoyl]phenyl]pyridine-3-carboxamide CAS Name: N-[3-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]-oxomethyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[1,3-benzothiazol-2-ylmethyl(methyl)carbamoyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[3-[1,3-benzothiazol-2-ylmethyl(methyl)carbamoyl]phenyl]nicotinamide Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H18N4O2S/c1-26(14-20-25-18-9-2-3-10-19(18)29-20)22(28)15-6-4-8-17(12-15)24-21(27)16-7-5-11-23-13-16/h2-13H,14H2,1H3,(H,24,27)