N-[(1S)-2-(cyclohexylamino)-1-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[(1S)-2-(cyclohexylamino)-1-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1S)-2-(cyclohexylamino)-1-(4-ethoxyphenyl)-2-oxo-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide CAS Name: N-[(1S)-2-(cyclohexylamino)-1-(4-ethoxyphenyl)-2-oxoethyl]-N-cyclopropyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1S)-2-(cyclohexylamino)-1-(4-ethoxyphenyl)-2-oxoethyl]-N-cyclopropylthiadiazole-4-carboxamide Traditional Name: N-[(1S)-2-(cyclohexylamino)-2-keto-1-p-phenetyl-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(C3CC3)C(=O)C4=CSN=N4

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@@H](C(=O)NC2CCCCC2)N(C3CC3)C(=O)C4=CSN=N4

InChI

InChI=1S/C22H28N4O3S/c1-2-29-18-12-8-15(9-13-18)20(21(27)23-16-6-4-3-5-7-16)26(17-10-11-17)22(28)19-14-30-25-24-19/h8-9,12-14,16-17,20H,2-7,10-11H2,1H3,(H,23,27)/t20-/m0/s1