3-[4-[[2,6-bis(chloranyl)phenyl]methoxy]phenyl]-2-[[5-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]-1,3-dioxolan-4-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[4-[[2,6-bis(chloranyl)phenyl]methoxy]phenyl]-2-[[5-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]-1,3-dioxolan-4-yl]carbonylamino]propanoic acid Openeye Name: 3-[4-[(2,6-dichlorophenyl)methoxy]phenyl]-2-[[5-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]-1,3-dioxolane-4-carbonyl]amino]propanoic acid CAS Name: 3-[4-[(2,6-dichlorophenyl)methoxy]phenyl]-2-[[[5-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-oxomethyl]-1,3-dioxolan-4-yl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[4-[(2,6-dichlorophenyl)methoxy]phenyl]-2-[[5-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]-1,3-dioxolane-4-carbonyl]amino]propanoic acid Traditional Name: 3-[4-(2,6-dichlorobenzyl)oxyphenyl]-2-[[5-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]-1,3-dioxolane-4-carbonyl]amino]propionic acid Formula: C24H22Cl2N4O7S MolecularWeight: 581.42508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)C2C(OCO2)C(=O)NC(CC3=CC=C(C=C3)OCC4=C(C=CC=C4Cl)Cl)C(=O)O

Isomeric SMILES

CC1=NN=C(S1)NC(=O)C2C(OCO2)C(=O)NC(CC3=CC=C(C=C3)OCC4=C(C=CC=C4Cl)Cl)C(=O)O

InChI

InChI=1S/C24H22Cl2N4O7S/c1-12-29-30-24(38-12)28-22(32)20-19(36-11-37-20)21(31)27-18(23(33)34)9-13-5-7-14(8-6-13)35-10-15-16(25)3-2-4-17(15)26/h2-8,18-20H,9-11H2,1H3,(H,27,31)(H,33,34)(H,28,30,32)