N-cyclohexyl-2-(phenylmethylsulfanyl)-[1]benzothiolo[3,2-d]pyrimidin-4-amine

Systemtic Name: N-cyclohexyl-2-(phenylmethylsulfanyl)-[1]benzothiolo[3,2-d]pyrimidin-4-amine Openeye Name: 2-benzylsulfanyl-N-cyclohexyl-benzothiopheno[3,2-d]pyrimidin-4-amine CAS Name: N-cyclohexyl-2-(phenylmethylthio)-[1]benzothiolo[3,2-d]pyrimidin-4-amine IUPAC Name: 2-benzylsulfanyl-N-cyclohexyl-[1]benzothiolo[3,2-d]pyrimidin-4-amine Traditional Name: [2-(benzylthio)benzothiopheno[3,2-d]pyrimidin-4-yl]-cyclohexyl-amine Formula: C23H23N3S2 MolecularWeight: 405.57882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=NC3=C2SC4=CC=CC=C43)SCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC2=NC(=NC3=C2SC4=CC=CC=C43)SCC5=CC=CC=C5

InChI

InChI=1S/C23H23N3S2/c1-3-9-16(10-4-1)15-27-23-25-20-18-13-7-8-14-19(18)28-21(20)22(26-23)24-17-11-5-2-6-12-17/h1,3-4,7-10,13-14,17H,2,5-6,11-12,15H2,(H,24,25,26)