N-[3-(azetidin-1-yl)propyl]-4-methyl-N-[1-[3-methyl-4-oxidanylidene-5-(phenylmethyl)-[1,2]thiazolo[5,4-d]pyrimidin-6-yl]propyl]benzamide

Systemtic Name: N-[3-(azetidin-1-yl)propyl]-4-methyl-N-[1-[3-methyl-4-oxidanylidene-5-(phenylmethyl)-[1,2]thiazolo[5,4-d]pyrimidin-6-yl]propyl]benzamide Openeye Name: N-[3-(azetidin-1-yl)propyl]-N-[1-(5-benzyl-3-methyl-4-oxo-isothiazolo[5,4-d]pyrimidin-6-yl)propyl]-4-methyl-benzamide CAS Name: N-[3-(1-azetidinyl)propyl]-4-methyl-N-[1-[3-methyl-4-oxo-5-(phenylmethyl)-6-isothiazolo[5,4-d]pyrimidinyl]propyl]benzamide IUPAC Name: N-[3-(azetidin-1-yl)propyl]-N-[1-(5-benzyl-3-methyl-4-oxo-[1,2]thiazolo[5,4-d]pyrimidin-6-yl)propyl]-4-methylbenzamide Traditional Name: N-[3-(azetidin-1-yl)propyl]-N-[1-(5-benzyl-4-keto-3-methyl-isothiazolo[5,4-d]pyrimidin-6-yl)propyl]-4-methyl-benzamide Formula: C30H35N5O2S MolecularWeight: 529.6962

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C(=NS2)C)C(=O)N1CC3=CC=CC=C3)N(CCCN4CCC4)C(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCC(C1=NC2=C(C(=NS2)C)C(=O)N1CC3=CC=CC=C3)N(CCCN4CCC4)C(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C30H35N5O2S/c1-4-25(34(19-9-18-33-16-8-17-33)29(36)24-14-12-21(2)13-15-24)27-31-28-26(22(3)32-38-28)30(37)35(27)20-23-10-6-5-7-11-23/h5-7,10-15,25H,4,8-9,16-20H2,1-3H3