N-cycloheptyl-7-oxidanylidene-6-(phenylmethyl)-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide

Systemtic Name: N-cycloheptyl-7-oxidanylidene-6-(phenylmethyl)-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide Openeye Name: 6-benzyl-N-cycloheptyl-7-oxo-isothiazolo[4,3-d]pyrimidine-3-carboxamide CAS Name: N-cycloheptyl-7-oxo-6-(phenylmethyl)-3-isothiazolo[4,3-d]pyrimidinecarboxamide IUPAC Name: 6-benzyl-N-cycloheptyl-7-oxo-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide Traditional Name: 6-benzyl-N-cycloheptyl-7-keto-isothiazolo[4,3-d]pyrimidine-3-carboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=C3C(=NS2)C(=O)N(C=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=C3C(=NS2)C(=O)N(C=N3)CC4=CC=CC=C4

InChI

InChI=1S/C20H22N4O2S/c25-19(22-15-10-6-1-2-7-11-15)18-16-17(23-27-18)20(26)24(13-21-16)12-14-8-4-3-5-9-14/h3-5,8-9,13,15H,1-2,6-7,10-12H2,(H,22,25)