N-[2-[(5-tert-butyl-2-methoxy-phenyl)carbamoyl]-1-benzothiophen-7-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-[(5-tert-butyl-2-methoxy-phenyl)carbamoyl]-1-benzothiophen-7-yl]pyridine-3-carboxamide Openeye Name: N-[2-[(5-tert-butyl-2-methoxy-phenyl)carbamoyl]benzothiophen-7-yl]pyridine-3-carboxamide CAS Name: N-[2-[(5-tert-butyl-2-methoxyanilino)-oxomethyl]-1-benzothiophen-7-yl]-3-pyridinecarboxamide IUPAC Name: N-[2-[(5-tert-butyl-2-methoxyphenyl)carbamoyl]-1-benzothiophen-7-yl]pyridine-3-carboxamide Traditional Name: N-[2-[(5-tert-butyl-2-methoxy-phenyl)carbamoyl]benzothiophen-7-yl]nicotinamide Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(S2)C(=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(S2)C(=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C26H25N3O3S/c1-26(2,3)18-10-11-21(32-4)20(14-18)29-25(31)22-13-16-7-5-9-19(23(16)33-22)28-24(30)17-8-6-12-27-15-17/h5-15H,1-4H3,(H,28,30)(H,29,31)