3-azanyl-2-[(4-methylphenyl)amino]-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-2-[(4-methylphenyl)amino]-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 3-amino-2-(4-methylanilino)benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 3-amino-2-(4-methylanilino)-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-amino-2-(4-methylanilino)-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 3-amino-2-(p-toluidino)benzothiopheno[3,2-d]pyrimidin-4-one Formula: C17H14N4OS MolecularWeight: 322.38426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC3=C(C(=O)N2N)SC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC3=C(C(=O)N2N)SC4=CC=CC=C43

InChI

InChI=1S/C17H14N4OS/c1-10-6-8-11(9-7-10)19-17-20-14-12-4-2-3-5-13(12)23-15(14)16(22)21(17)18/h2-9H,18H2,1H3,(H,19,20)