5-(3-morpholin-4-ylpropylamino)-3-oxidanylidene-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-(3-morpholin-4-ylpropylamino)-3-oxidanylidene-1,2-thiazole-4-carbonitrile Openeye Name: 5-(3-morpholinopropylamino)-3-oxo-isothiazole-4-carbonitrile CAS Name: 5-[3-(4-morpholinyl)propylamino]-3-oxo-4-isothiazolecarbonitrile IUPAC Name: 5-(3-morpholin-4-ylpropylamino)-3-oxo-1,2-thiazole-4-carbonitrile Traditional Name: 3-keto-5-(3-morpholinopropylamino)-4-isothiazoline-4-carbonitrile Formula: C11H16N4O2S MolecularWeight: 268.33534

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=C(C(=O)NS2)C#N

Isomeric SMILES

C1COCCN1CCCNC2=C(C(=O)NS2)C#N

InChI

InChI=1S/C11H16N4O2S/c12-8-9-10(16)14-18-11(9)13-2-1-3-15-4-6-17-7-5-15/h13H,1-7H2,(H,14,16)