ethyl 4-[4-methyl-2-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonylamino]pentanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-methyl-2-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonylamino]pentanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[4-methyl-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]pentanoyl]piperazine-1-carboxylate CAS Name: 4-[4-methyl-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-1-oxopentyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-methyl-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]pentanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonylamino]-4-methyl-pentanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H30N4O7S MolecularWeight: 482.5505

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CC(C)C)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(CC(C)C)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)C

InChI

InChI=1S/C21H30N4O7S/c1-5-31-21(28)25-10-8-24(9-11-25)19(26)16(12-14(2)3)22-33(29,30)15-6-7-17-18(13-15)32-20(27)23(17)4/h6-7,13-14,16,22H,5,8-12H2,1-4H3