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

Systemtic Name: 5-(6-chloranyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(4-methylsulfanylphenyl)methyl]thiophene-2-carboxamide Openeye Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(4-methylsulfanylphenyl)methyl]thiophene-2-carboxamide CAS Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[[4-(methylthio)phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(4-methylsulfanylphenyl)methyl]thiophene-2-carboxamide Traditional Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[4-(methylthio)benzyl]thiophene-2-carboxamide Formula: C21H19ClN2O2S2 MolecularWeight: 430.97076

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2=CC=C(S2)N3CCOC4=C3C=C(C=C4)Cl

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)C2=CC=C(S2)N3CCOC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN2O2S2/c1-27-16-5-2-14(3-6-16)13-23-21(25)19-8-9-20(28-19)24-10-11-26-18-7-4-15(22)12-17(18)24/h2-9,12H,10-11,13H2,1H3,(H,23,25)