4-[2-[(4-chlorophenyl)sulfonylamino]propanoylamino]-5-[[5-methyl-4-oxidanylidene-2-(propan-2-ylamino)-3,1-benzoxazin-7-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[2-[(4-chlorophenyl)sulfonylamino]propanoylamino]-5-[[5-methyl-4-oxidanylidene-2-(propan-2-ylamino)-3,1-benzoxazin-7-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-[2-[(4-chlorophenyl)sulfonylamino]propanoylamino]-5-[[2-(isopropylamino)-5-methyl-4-oxo-3,1-benzoxazin-7-yl]amino]-5-oxo-pentanoic acid CAS Name: 4-[[2-[(4-chlorophenyl)sulfonylamino]-1-oxopropyl]amino]-5-[[5-methyl-4-oxo-2-(propan-2-ylamino)-3,1-benzoxazin-7-yl]amino]-5-oxopentanoic acid IUPAC Name: 4-[2-[(4-chlorophenyl)sulfonylamino]propanoylamino]-5-[[5-methyl-4-oxo-2-(propan-2-ylamino)-3,1-benzoxazin-7-yl]amino]-5-oxopentanoic acid Traditional Name: 4-[2-[(4-chlorophenyl)sulfonylamino]propanoylamino]-5-[[2-(isopropylamino)-4-keto-5-methyl-3,1-benzoxazin-7-yl]amino]-5-keto-valeric acid Formula: C26H30ClN5O8S MolecularWeight: 608.0631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)OC(=N2)NC(C)C)NC(=O)C(CCC(=O)O)NC(=O)C(C)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)OC(=N2)NC(C)C)NC(=O)C(CCC(=O)O)NC(=O)C(C)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H30ClN5O8S/c1-13(2)28-26-31-20-12-17(11-14(3)22(20)25(37)40-26)29-24(36)19(9-10-21(33)34)30-23(35)15(4)32-41(38,39)18-7-5-16(27)6-8-18/h5-8,11-13,15,19,32H,9-10H2,1-4H3,(H,28,31)(H,29,36)(H,30,35)(H,33,34)