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

Systemtic Name: N-[(4-butoxyphenyl)methyl]-5-(6-chloranyl-2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide Openeye Name: N-[(4-butoxyphenyl)methyl]-5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide CAS Name: N-[(4-butoxyphenyl)methyl]-5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-2-thiophenecarboxamide IUPAC Name: N-[(4-butoxyphenyl)methyl]-5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide Traditional Name: N-(4-butoxybenzyl)-5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide Formula: C24H25ClN2O3S MolecularWeight: 456.9849

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CNC(=O)C2=CC=C(S2)N3CCOC4=C3C=C(C=C4)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CNC(=O)C2=CC=C(S2)N3CCOC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C24H25ClN2O3S/c1-2-3-13-29-19-7-4-17(5-8-19)16-26-24(28)22-10-11-23(31-22)27-12-14-30-21-9-6-18(25)15-20(21)27/h4-11,15H,2-3,12-14,16H2,1H3,(H,26,28)