N-[2-(3,4-diethoxyphenyl)ethyl]-5-(2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-5-(2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-5-(2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-5-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-thiophenecarboxamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-5-(2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-5-(2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide Formula: C25H28N2O4S MolecularWeight: 452.56582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(S2)N3CCOC4=CC=CC=C43)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(S2)N3CCOC4=CC=CC=C43)OCC

InChI

InChI=1S/C25H28N2O4S/c1-3-29-21-10-9-18(17-22(21)30-4-2)13-14-26-25(28)23-11-12-24(32-23)27-15-16-31-20-8-6-5-7-19(20)27/h5-12,17H,3-4,13-16H2,1-2H3,(H,26,28)