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

Systemtic Name: N-[(1R)-2-(cyclopentylamino)-1-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1R)-2-(cyclopentylamino)-1-(3-methoxyphenyl)-2-oxo-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide CAS Name: N-[(1R)-2-(cyclopentylamino)-1-(3-methoxyphenyl)-2-oxoethyl]-N-cyclopropyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1R)-2-(cyclopentylamino)-1-(3-methoxyphenyl)-2-oxoethyl]-N-cyclopropylthiadiazole-4-carboxamide Traditional Name: N-[(1R)-2-(cyclopentylamino)-2-keto-1-(3-methoxyphenyl)ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C(=O)NC2CCCC2)N(C3CC3)C(=O)C4=CSN=N4

Isomeric SMILES

COC1=CC=CC(=C1)[C@H](C(=O)NC2CCCC2)N(C3CC3)C(=O)C4=CSN=N4

InChI

InChI=1S/C20H24N4O3S/c1-27-16-8-4-5-13(11-16)18(19(25)21-14-6-2-3-7-14)24(15-9-10-15)20(26)17-12-28-23-22-17/h4-5,8,11-12,14-15,18H,2-3,6-7,9-10H2,1H3,(H,21,25)/t18-/m1/s1