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2-[carboxy-[3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]amino]-4-methyl-pentanoic acid

2-[carboxy-[3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]amino]-4-methyl-pentanoic acid

Systemtic Name:2-[carboxy-[3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]amino]-4-methyl-pentanoic acid
Openeye Name:2-[carboxy-[3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxo-propyl]amino]-4-methyl-pentanoic acid
CAS Name:2-[carboxy-[3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]amino]-4-methylpentanoic acid
IUPAC Name:2-[carboxy-[3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]amino]-4-methylpentanoic acid
Traditional Name:2-[carboxy-[3-keto-3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]propyl]amino]-4-methyl-valeric acid
Formula: C18H23N3O6S
MolecularWeight: 409.45672
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC(=O)NC1=NC2=C(S1)C=C(C=C2)OC)C(=O)O


Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC(=O)NC1=NC2=C(S1)C=C(C=C2)OC)C(=O)O


InChI

InChI=1S/C18H23N3O6S/c1-10(2)8-13(16(23)24)21(18(25)26)7-6-15(22)20-17-19-12-5-4-11(27-3)9-14(12)28-17/h4-5,9-10,13H,6-8H2,1-3H3,(H,23,24)(H,25,26)(H,19,20,22)


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