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

Systemtic Name: N-(3-azanylpropyl)-N-[1-[3-methyl-4-oxidanylidene-5-(phenylmethyl)-[1,2]thiazolo[5,4-d]pyrimidin-6-yl]propyl]naphthalene-2-carboxamide Openeye Name: N-(3-aminopropyl)-N-[1-(5-benzyl-3-methyl-4-oxo-isothiazolo[5,4-d]pyrimidin-6-yl)propyl]naphthalene-2-carboxamide CAS Name: N-(3-aminopropyl)-N-[1-[3-methyl-4-oxo-5-(phenylmethyl)-6-isothiazolo[5,4-d]pyrimidinyl]propyl]-2-naphthalenecarboxamide IUPAC Name: N-(3-aminopropyl)-N-[1-(5-benzyl-3-methyl-4-oxo-[1,2]thiazolo[5,4-d]pyrimidin-6-yl)propyl]naphthalene-2-carboxamide Traditional Name: N-(3-aminopropyl)-N-[1-(5-benzyl-4-keto-3-methyl-isothiazolo[5,4-d]pyrimidin-6-yl)propyl]-2-naphthamide Formula: C30H31N5O2S MolecularWeight: 525.66444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C(=NS2)C)C(=O)N1CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CCC(C1=NC2=C(C(=NS2)C)C(=O)N1CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C30H31N5O2S/c1-3-25(34(17-9-16-31)29(36)24-15-14-22-12-7-8-13-23(22)18-24)27-32-28-26(20(2)33-38-28)30(37)35(27)19-21-10-5-4-6-11-21/h4-8,10-15,18,25H,3,9,16-17,19,31H2,1-2H3