N-[(5-chloranylthiophen-2-yl)methyl]-2-[(3,4-dimethoxyphenyl)methyl]-1,3-benzoxazole-6-carboxamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-2-[(3,4-dimethoxyphenyl)methyl]-1,3-benzoxazole-6-carboxamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-2-[(3,4-dimethoxyphenyl)methyl]-1,3-benzoxazole-6-carboxamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-2-[(3,4-dimethoxyphenyl)methyl]-1,3-benzoxazole-6-carboxamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-2-[(3,4-dimethoxyphenyl)methyl]-1,3-benzoxazole-6-carboxamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-2-veratryl-1,3-benzoxazole-6-carboxamide Formula: C22H19ClN2O4S MolecularWeight: 442.91526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC3=C(O2)C=C(C=C3)C(=O)NCC4=CC=C(S4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NC3=C(O2)C=C(C=C3)C(=O)NCC4=CC=C(S4)Cl)OC

InChI

InChI=1S/C22H19ClN2O4S/c1-27-17-7-3-13(9-19(17)28-2)10-21-25-16-6-4-14(11-18(16)29-21)22(26)24-12-15-5-8-20(23)30-15/h3-9,11H,10,12H2,1-2H3,(H,24,26)