N-cyclopropyl-2-[(4-methylphenyl)methylsulfanyl]-[1]benzothiolo[3,2-d]pyrimidin-4-amine

Systemtic Name: N-cyclopropyl-2-[(4-methylphenyl)methylsulfanyl]-[1]benzothiolo[3,2-d]pyrimidin-4-amine Openeye Name: N-cyclopropyl-2-(p-tolylmethylsulfanyl)benzothiopheno[3,2-d]pyrimidin-4-amine CAS Name: N-cyclopropyl-2-[(4-methylphenyl)methylthio]-[1]benzothiolo[3,2-d]pyrimidin-4-amine IUPAC Name: N-cyclopropyl-2-[(4-methylphenyl)methylsulfanyl]-[1]benzothiolo[3,2-d]pyrimidin-4-amine Traditional Name: cyclopropyl-[2-[(4-methylbenzyl)thio]benzothiopheno[3,2-d]pyrimidin-4-yl]amine Formula: C21H19N3S2 MolecularWeight: 377.52566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(C(=N2)NC4CC4)SC5=CC=CC=C53

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(C(=N2)NC4CC4)SC5=CC=CC=C53

InChI

InChI=1S/C21H19N3S2/c1-13-6-8-14(9-7-13)12-25-21-23-18-16-4-2-3-5-17(16)26-19(18)20(24-21)22-15-10-11-15/h2-9,15H,10-12H2,1H3,(H,22,23,24)