N-[2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-3-yl-ethyl]-5-oxidanylidene-N-(phenylmethyl)thiolane-3-carboxamide

Systemtic Name: N-[2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-3-yl-ethyl]-5-oxidanylidene-N-(phenylmethyl)thiolane-3-carboxamide Openeye Name: N-benzyl-N-[2-(cyclopentylamino)-2-oxo-1-(3-pyridyl)ethyl]-5-oxo-tetrahydrothiophene-3-carboxamide CAS Name: N-[2-(cyclopentylamino)-2-oxo-1-(3-pyridinyl)ethyl]-5-oxo-N-(phenylmethyl)-3-thiolanecarboxamide IUPAC Name: N-benzyl-N-[2-(cyclopentylamino)-2-oxo-1-pyridin-3-ylethyl]-5-oxothiolane-3-carboxamide Traditional Name: N-benzyl-N-[2-(cyclopentylamino)-2-keto-1-(3-pyridyl)ethyl]-5-keto-tetrahydrothiophene-3-carboxamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(C2=CN=CC=C2)N(CC3=CC=CC=C3)C(=O)C4CC(=O)SC4

Isomeric SMILES

C1CCC(C1)NC(=O)C(C2=CN=CC=C2)N(CC3=CC=CC=C3)C(=O)C4CC(=O)SC4

InChI

InChI=1S/C24H27N3O3S/c28-21-13-19(16-31-21)24(30)27(15-17-7-2-1-3-8-17)22(18-9-6-12-25-14-18)23(29)26-20-10-4-5-11-20/h1-3,6-9,12,14,19-20,22H,4-5,10-11,13,15-16H2,(H,26,29)