5-(4-chlorophenyl)-6-methyl-N-piperidin-1-ium-4-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-chlorophenyl)-6-methyl-N-piperidin-1-ium-4-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-chlorophenyl)-6-methyl-N-piperidin-1-ium-4-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-chlorophenyl)-6-methyl-N-(4-piperidin-1-iumyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-chlorophenyl)-6-methyl-N-piperidin-1-ium-4-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(4-chlorophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]-piperidin-1-ium-4-yl-amine Formula: C18H20ClN4S+ MolecularWeight: 359.8962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)NC3CC[NH2+]CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)NC3CC[NH2+]CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H19ClN4S/c1-11-15(12-2-4-13(19)5-3-12)16-17(21-10-22-18(16)24-11)23-14-6-8-20-9-7-14/h2-5,10,14,20H,6-9H2,1H3,(H,21,22,23)/p+1