2-[[6-(2-cyclopentylethanoylamino)-1,4-benzoxazin-4-yl]methyl]-3-methoxy-N-(phenylsulfonyl)benzamide

Systemtic Name: 2-[[6-(2-cyclopentylethanoylamino)-1,4-benzoxazin-4-yl]methyl]-3-methoxy-N-(phenylsulfonyl)benzamide Openeye Name: N-(benzenesulfonyl)-2-[[6-[(2-cyclopentylacetyl)amino]-1,4-benzoxazin-4-yl]methyl]-3-methoxy-benzamide CAS Name: N-(benzenesulfonyl)-2-[[6-[(2-cyclopentyl-1-oxoethyl)amino]-1,4-benzoxazin-4-yl]methyl]-3-methoxybenzamide IUPAC Name: N-(benzenesulfonyl)-2-[[6-[(2-cyclopentylacetyl)amino]-1,4-benzoxazin-4-yl]methyl]-3-methoxybenzamide Traditional Name: N-besyl-2-[[6-[(2-cyclopentylacetyl)amino]-1,4-benzoxazin-4-yl]methyl]-3-methoxy-benzamide Formula: C30H31N3O6S MolecularWeight: 561.64864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1CN2C=COC3=C2C=C(C=C3)NC(=O)CC4CCCC4)C(=O)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1CN2C=COC3=C2C=C(C=C3)NC(=O)CC4CCCC4)C(=O)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H31N3O6S/c1-38-27-13-7-12-24(30(35)32-40(36,37)23-10-3-2-4-11-23)25(27)20-33-16-17-39-28-15-14-22(19-26(28)33)31-29(34)18-21-8-5-6-9-21/h2-4,7,10-17,19,21H,5-6,8-9,18,20H2,1H3,(H,31,34)(H,32,35)