2-[6-(azepan-1-ylsulfonyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[2-(1H-indol-3-yl)ethyl]ethanamide

Systemtic Name: 2-[6-(azepan-1-ylsulfonyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[2-(1H-indol-3-yl)ethyl]ethanamide Openeye Name: 2-[6-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzoxazin-4-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide CAS Name: 2-[6-(1-azepanylsulfonyl)-3-oxo-1,4-benzoxazin-4-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide IUPAC Name: 2-[6-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzoxazin-4-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide Traditional Name: 2-[6-(azepan-1-ylsulfonyl)-3-keto-1,4-benzoxazin-4-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide Formula: C26H30N4O5S MolecularWeight: 510.6052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)NCCC4=CNC5=CC=CC=C54

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)NCCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H30N4O5S/c31-25(27-12-11-19-16-28-22-8-4-3-7-21(19)22)17-30-23-15-20(9-10-24(23)35-18-26(30)32)36(33,34)29-13-5-1-2-6-14-29/h3-4,7-10,15-16,28H,1-2,5-6,11-14,17-18H2,(H,27,31)