ethyl 2-[5-[(4-propan-2-ylphenyl)carbonylamino]-1,3,4-thiadiazol-2-yl]ethanoate

Systemtic Name: ethyl 2-[5-[(4-propan-2-ylphenyl)carbonylamino]-1,3,4-thiadiazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-[(4-isopropylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]acetate CAS Name: 2-[5-[[oxo-(4-propan-2-ylphenyl)methyl]amino]-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-[(4-propan-2-ylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]acetate Traditional Name: 2-[5-(cumoylamino)-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCOC(=O)CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C16H19N3O3S/c1-4-22-14(20)9-13-18-19-16(23-13)17-15(21)12-7-5-11(6-8-12)10(2)3/h5-8,10H,4,9H2,1-3H3,(H,17,19,21)