N-cyclopropyl-N-[(1S)-2-oxidanylidene-2-(phenethylamino)-1-pyridin-2-yl-ethyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-cyclopropyl-N-[(1S)-2-oxidanylidene-2-(phenethylamino)-1-pyridin-2-yl-ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-cyclopropyl-N-[(1S)-2-oxo-2-(phenethylamino)-1-(2-pyridyl)ethyl]thiadiazole-4-carboxamide CAS Name: N-cyclopropyl-N-[(1S)-2-oxo-2-(phenethylamino)-1-(2-pyridinyl)ethyl]-4-thiadiazolecarboxamide IUPAC Name: N-cyclopropyl-N-[(1S)-2-oxo-2-(phenethylamino)-1-pyridin-2-ylethyl]thiadiazole-4-carboxamide Traditional Name: N-cyclopropyl-N-[(1S)-2-keto-2-(phenethylamino)-1-(2-pyridyl)ethyl]thiadiazole-4-carboxamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C(C2=CC=CC=N2)C(=O)NCCC3=CC=CC=C3)C(=O)C4=CSN=N4

Isomeric SMILES

C1CC1N([C@@H](C2=CC=CC=N2)C(=O)NCCC3=CC=CC=C3)C(=O)C4=CSN=N4

InChI

InChI=1S/C21H21N5O2S/c27-20(23-13-11-15-6-2-1-3-7-15)19(17-8-4-5-12-22-17)26(16-9-10-16)21(28)18-14-29-25-24-18/h1-8,12,14,16,19H,9-11,13H2,(H,23,27)/t19-/m0/s1