2-[(3-chloranyl-1-benzothiophen-2-yl)methylsulfanyl]pyrimidine-4,6-diamine

Systemtic Name: 2-[(3-chloranyl-1-benzothiophen-2-yl)methylsulfanyl]pyrimidine-4,6-diamine Openeye Name: 2-[(3-chlorobenzothiophen-2-yl)methylsulfanyl]pyrimidine-4,6-diamine CAS Name: 2-[(3-chloro-1-benzothiophen-2-yl)methylthio]pyrimidine-4,6-diamine IUPAC Name: 2-[(3-chloro-1-benzothiophen-2-yl)methylsulfanyl]pyrimidine-4,6-diamine Traditional Name: [6-amino-2-[(3-chlorobenzothiophen-2-yl)methylthio]pyrimidin-4-yl]amine Formula: C13H11ClN4S2 MolecularWeight: 322.83624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)CSC3=NC(=CC(=N3)N)N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)CSC3=NC(=CC(=N3)N)N)Cl

InChI

InChI=1S/C13H11ClN4S2/c14-12-7-3-1-2-4-8(7)20-9(12)6-19-13-17-10(15)5-11(16)18-13/h1-5H,6H2,(H4,15,16,17,18)