N-[4-[2-(diphenylmethyl)sulfanylethanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[2-(diphenylmethyl)sulfanylethanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[(2-benzhydrylsulfanylacetyl)amino]-2-methoxy-phenyl]pyridine-3-carboxamide CAS Name: N-[4-[[2-[(diphenylmethyl)thio]-1-oxoethyl]amino]-2-methoxyphenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[(2-benzhydrylsulfanylacetyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide Traditional Name: N-[4-[[2-(benzhydrylthio)acetyl]amino]-2-methoxy-phenyl]nicotinamide Formula: C28H25N3O3S MolecularWeight: 483.5814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)CSC(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)CSC(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C28H25N3O3S/c1-34-25-17-23(14-15-24(25)31-28(33)22-13-8-16-29-18-22)30-26(32)19-35-27(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-18,27H,19H2,1H3,(H,30,32)(H,31,33)