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

Systemtic Name: N-[[6-(2-cyclopentylethanoylamino)-1,4-benzoxazin-4-yl]methyl]-3-methoxy-N-(phenylsulfonyl)benzamide Openeye Name: N-(benzenesulfonyl)-N-[[6-[(2-cyclopentylacetyl)amino]-1,4-benzoxazin-4-yl]methyl]-3-methoxy-benzamide CAS Name: N-(benzenesulfonyl)-N-[[6-[(2-cyclopentyl-1-oxoethyl)amino]-1,4-benzoxazin-4-yl]methyl]-3-methoxybenzamide IUPAC Name: N-(benzenesulfonyl)-N-[[6-[(2-cyclopentylacetyl)amino]-1,4-benzoxazin-4-yl]methyl]-3-methoxybenzamide Traditional Name: N-besyl-N-[[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(=C1)C(=O)N(CN2C=COC3=C2C=C(C=C3)NC(=O)CC4CCCC4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N(CN2C=COC3=C2C=C(C=C3)NC(=O)CC4CCCC4)S(=O)(=O)C5=CC=CC=C5

InChI

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