4-[3-methyl-5-(pyridin-3-ylamino)-1-benzothiophen-2-yl]pyrimidin-2-amine

Systemtic Name: 4-[3-methyl-5-(pyridin-3-ylamino)-1-benzothiophen-2-yl]pyrimidin-2-amine Openeye Name: 4-[3-methyl-5-(3-pyridylamino)benzothiophen-2-yl]pyrimidin-2-amine CAS Name: 4-[3-methyl-5-(3-pyridinylamino)-1-benzothiophen-2-yl]-2-pyrimidinamine IUPAC Name: 4-[3-methyl-5-(pyridin-3-ylamino)-1-benzothiophen-2-yl]pyrimidin-2-amine Traditional Name: [2-(2-aminopyrimidin-4-yl)-3-methyl-benzothiophen-5-yl]-(3-pyridyl)amine Formula: C18H15N5S MolecularWeight: 333.4102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)NC3=CN=CC=C3)C4=NC(=NC=C4)N

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)NC3=CN=CC=C3)C4=NC(=NC=C4)N

InChI

InChI=1S/C18H15N5S/c1-11-14-9-12(22-13-3-2-7-20-10-13)4-5-16(14)24-17(11)15-6-8-21-18(19)23-15/h2-10,22H,1H3,(H2,19,21,23)