5-(6-chloranyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(2,5-dimethoxyphenyl)methyl]thiophene-2-carboxamide

Systemtic Name: 5-(6-chloranyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(2,5-dimethoxyphenyl)methyl]thiophene-2-carboxamide Openeye Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(2,5-dimethoxyphenyl)methyl]thiophene-2-carboxamide CAS Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(2,5-dimethoxyphenyl)methyl]-2-thiophenecarboxamide IUPAC Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(2,5-dimethoxyphenyl)methyl]thiophene-2-carboxamide Traditional Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-(2,5-dimethoxybenzyl)thiophene-2-carboxamide Formula: C22H21ClN2O4S MolecularWeight: 444.93114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNC(=O)C2=CC=C(S2)N3CCOC4=C3C=C(C=C4)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNC(=O)C2=CC=C(S2)N3CCOC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C22H21ClN2O4S/c1-27-16-4-6-18(28-2)14(11-16)13-24-22(26)20-7-8-21(30-20)25-9-10-29-19-5-3-15(23)12-17(19)25/h3-8,11-12H,9-10,13H2,1-2H3,(H,24,26)