N-cyclopentyl-N-[(1S)-2-oxidanylidene-2-[(phenylmethyl)amino]-1-pyridin-3-yl-ethyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-cyclopentyl-N-[(1S)-2-oxidanylidene-2-[(phenylmethyl)amino]-1-pyridin-3-yl-ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1S)-2-(benzylamino)-2-oxo-1-(3-pyridyl)ethyl]-N-cyclopentyl-thiadiazole-4-carboxamide CAS Name: N-cyclopentyl-N-[(1S)-2-oxo-2-[(phenylmethyl)amino]-1-(3-pyridinyl)ethyl]-4-thiadiazolecarboxamide IUPAC Name: N-[(1S)-2-(benzylamino)-2-oxo-1-pyridin-3-ylethyl]-N-cyclopentylthiadiazole-4-carboxamide Traditional Name: N-[(1S)-2-(benzylamino)-2-keto-1-(3-pyridyl)ethyl]-N-cyclopentyl-thiadiazole-4-carboxamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(C(C2=CN=CC=C2)C(=O)NCC3=CC=CC=C3)C(=O)C4=CSN=N4

Isomeric SMILES

C1CCC(C1)N([C@@H](C2=CN=CC=C2)C(=O)NCC3=CC=CC=C3)C(=O)C4=CSN=N4

InChI

InChI=1S/C22H23N5O2S/c28-21(24-13-16-7-2-1-3-8-16)20(17-9-6-12-23-14-17)27(18-10-4-5-11-18)22(29)19-15-30-26-25-19/h1-3,6-9,12,14-15,18,20H,4-5,10-11,13H2,(H,24,28)/t20-/m0/s1