N-[[(3R)-1-(1-methyl-6-oxidanylidene-pyridazin-4-yl)pyrrolidin-3-yl]methyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[[(3R)-1-(1-methyl-6-oxidanylidene-pyridazin-4-yl)pyrrolidin-3-yl]methyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[[(3R)-1-(1-methyl-6-oxo-pyridazin-4-yl)pyrrolidin-3-yl]methyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[[(3R)-1-(1-methyl-6-oxo-4-pyridazinyl)-3-pyrrolidinyl]methyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[[(3R)-1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-[[(3R)-1-(6-keto-1-methyl-pyridazin-4-yl)pyrrolidin-3-yl]methyl]-1,3-benzothiazole-2-carboxamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(C=N1)N2CCC(C2)CNC(=O)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CN1C(=O)C=C(C=N1)N2CC[C@@H](C2)CNC(=O)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H19N5O2S/c1-22-16(24)8-13(10-20-22)23-7-6-12(11-23)9-19-17(25)18-21-14-4-2-3-5-15(14)26-18/h2-5,8,10,12H,6-7,9,11H2,1H3,(H,19,25)/t12-/m1/s1