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

Systemtic Name: N-[(1R)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1R)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxo-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide CAS Name: N-[(1R)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxoethyl]-N-cyclopropyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1R)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxoethyl]-N-cyclopropylthiadiazole-4-carboxamide Traditional Name: N-[(1R)-2-(cyclohexylamino)-2-keto-1-(3-methoxyphenyl)ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C(=O)NC2CCCCC2)N(C3CC3)C(=O)C4=CSN=N4

Isomeric SMILES

COC1=CC=CC(=C1)[C@H](C(=O)NC2CCCCC2)N(C3CC3)C(=O)C4=CSN=N4

InChI

InChI=1S/C21H26N4O3S/c1-28-17-9-5-6-14(12-17)19(20(26)22-15-7-3-2-4-8-15)25(16-10-11-16)21(27)18-13-29-24-23-18/h5-6,9,12-13,15-16,19H,2-4,7-8,10-11H2,1H3,(H,22,26)/t19-/m1/s1