N-[1-(2-aminocarbonylpyrrolidin-1-yl)-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]-2,3,6-trimethyl-5-oxidanylidene-thiomorpholine-3-carboxamide

Systemtic Name: N-[1-(2-aminocarbonylpyrrolidin-1-yl)-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]-2,3,6-trimethyl-5-oxidanylidene-thiomorpholine-3-carboxamide Openeye Name: N-[2-(2-carbamoylpyrrolidin-1-yl)-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]-2,3,6-trimethyl-5-oxo-thiomorpholine-3-carboxamide CAS Name: N-[1-(2-carbamoyl-1-pyrrolidinyl)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-2,3,6-trimethyl-5-oxo-3-thiomorpholinecarboxamide IUPAC Name: N-[1-(2-carbamoylpyrrolidin-1-yl)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-2,3,6-trimethyl-5-oxothiomorpholine-3-carboxamide Traditional Name: N-[2-(2-carbamoylpyrrolidino)-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]-5-keto-2,3,6-trimethyl-thiomorpholine-3-carboxamide Formula: C19H28N6O4S MolecularWeight: 436.52842

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC(C(S1)C)(C)C(=O)NC(CC2=CN=CN2)C(=O)N3CCCC3C(=O)N

Isomeric SMILES

CC1C(=O)NC(C(S1)C)(C)C(=O)NC(CC2=CN=CN2)C(=O)N3CCCC3C(=O)N

InChI

InChI=1S/C19H28N6O4S/c1-10-16(27)24-19(3,11(2)30-10)18(29)23-13(7-12-8-21-9-22-12)17(28)25-6-4-5-14(25)15(20)26/h8-11,13-14H,4-7H2,1-3H3,(H2,20,26)(H,21,22)(H,23,29)(H,24,27)