N-[(1S)-2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-3-yl-ethyl]-N-(4-propan-2-ylphenyl)-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[(1S)-2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-3-yl-ethyl]-N-(4-propan-2-ylphenyl)-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1S)-2-(cyclopentylamino)-2-oxo-1-(3-pyridyl)ethyl]-N-(4-isopropylphenyl)thiadiazole-4-carboxamide CAS Name: N-[(1S)-2-(cyclopentylamino)-2-oxo-1-(3-pyridinyl)ethyl]-N-(4-propan-2-ylphenyl)-4-thiadiazolecarboxamide IUPAC Name: N-[(1S)-2-(cyclopentylamino)-2-oxo-1-pyridin-3-ylethyl]-N-(4-propan-2-ylphenyl)thiadiazole-4-carboxamide Traditional Name: N-[(1S)-2-(cyclopentylamino)-2-keto-1-(3-pyridyl)ethyl]-N-p-cumenyl-thiadiazole-4-carboxamide Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(C(C2=CN=CC=C2)C(=O)NC3CCCC3)C(=O)C4=CSN=N4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N([C@@H](C2=CN=CC=C2)C(=O)NC3CCCC3)C(=O)C4=CSN=N4

InChI

InChI=1S/C24H27N5O2S/c1-16(2)17-9-11-20(12-10-17)29(24(31)21-15-32-28-27-21)22(18-6-5-13-25-14-18)23(30)26-19-7-3-4-8-19/h5-6,9-16,19,22H,3-4,7-8H2,1-2H3,(H,26,30)/t22-/m0/s1