3-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-[2-(4-methoxyphenyl)ethyl]thiophene-2-carboxamide

Systemtic Name: 3-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-[2-(4-methoxyphenyl)ethyl]thiophene-2-carboxamide Openeye Name: 3-[(2-acetamido-4-pyridyl)methylsulfanyl]-N-[2-(4-methoxyphenyl)ethyl]thiophene-2-carboxamide CAS Name: 3-[(2-acetamido-4-pyridinyl)methylthio]-N-[2-(4-methoxyphenyl)ethyl]-2-thiophenecarboxamide IUPAC Name: 3-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-[2-(4-methoxyphenyl)ethyl]thiophene-2-carboxamide Traditional Name: 3-[(2-acetamido-4-pyridyl)methylthio]-N-[2-(4-methoxyphenyl)ethyl]thiophene-2-carboxamide Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=CC(=C1)CSC2=C(SC=C2)C(=O)NCCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)NC1=NC=CC(=C1)CSC2=C(SC=C2)C(=O)NCCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H23N3O3S2/c1-15(26)25-20-13-17(8-10-23-20)14-30-19-9-12-29-21(19)22(27)24-11-7-16-3-5-18(28-2)6-4-16/h3-6,8-10,12-13H,7,11,14H2,1-2H3,(H,24,27)(H,23,25,26)