4-(2-methyl-1-oxidanylidene-isoquinolin-3-yl)-N-[5-[(5-propan-2-yl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]butanamide

Systemtic Name: 4-(2-methyl-1-oxidanylidene-isoquinolin-3-yl)-N-[5-[(5-propan-2-yl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]butanamide Openeye Name: N-[5-[(5-isopropyloxazol-2-yl)methylsulfanyl]thiazol-2-yl]-4-(2-methyl-1-oxo-3-isoquinolyl)butanamide CAS Name: 4-(2-methyl-1-oxo-3-isoquinolinyl)-N-[5-[(5-propan-2-yl-2-oxazolyl)methylthio]-2-thiazolyl]butanamide IUPAC Name: 4-(2-methyl-1-oxoisoquinolin-3-yl)-N-[5-[(5-propan-2-yl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]butanamide Traditional Name: N-[5-[(5-isopropyloxazol-2-yl)methylthio]thiazol-2-yl]-4-(1-keto-2-methyl-3-isoquinolyl)butyramide Formula: C24H26N4O3S2 MolecularWeight: 482.61824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CN=C(O1)CSC2=CN=C(S2)NC(=O)CCCC3=CC4=CC=CC=C4C(=O)N3C

Isomeric SMILES

CC(C)C1=CN=C(O1)CSC2=CN=C(S2)NC(=O)CCCC3=CC4=CC=CC=C4C(=O)N3C

InChI

InChI=1S/C24H26N4O3S2/c1-15(2)19-12-25-21(31-19)14-32-22-13-26-24(33-22)27-20(29)10-6-8-17-11-16-7-4-5-9-18(16)23(30)28(17)3/h4-5,7,9,11-13,15H,6,8,10,14H2,1-3H3,(H,26,27,29)