N-[4-[(4-propan-2-yloxyphenyl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[4-[(4-propan-2-yloxyphenyl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide Openeye Name: N-[4-[(4-isopropoxyphenyl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[4-[oxo-[(4-propan-2-yloxyphenyl)methylamino]methyl]phenyl]-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[4-[(4-propan-2-yloxyphenyl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide Traditional Name: N-[4-[(4-isopropoxybenzyl)carbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=NSC4=CC=CC=C43

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C25H23N3O3S/c1-16(2)31-20-13-7-17(8-14-20)15-26-24(29)18-9-11-19(12-10-18)27-25(30)23-21-5-3-4-6-22(21)32-28-23/h3-14,16H,15H2,1-2H3,(H,26,29)(H,27,30)