4-chloranyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-thiophen-2-yl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-chloranyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-thiophen-2-yl-thieno[2,3-d]pyrimidine Openeye Name: 4-chloro-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-(2-thienyl)thieno[2,3-d]pyrimidine CAS Name: 4-chloro-2-[(4-methyl-1-piperidin-1-iumyl)methyl]-5-thiophen-2-ylthieno[2,3-d]pyrimidine IUPAC Name: 4-chloro-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-thiophen-2-ylthieno[2,3-d]pyrimidine Traditional Name: 4-chloro-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-(2-thienyl)thieno[2,3-d]pyrimidine Formula: C17H19ClN3S2+ MolecularWeight: 364.93586

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=N2)Cl

Isomeric SMILES

CC1CC[NH+](CC1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=N2)Cl

InChI

InChI=1S/C17H18ClN3S2/c1-11-4-6-21(7-5-11)9-14-19-16(18)15-12(10-23-17(15)20-14)13-3-2-8-22-13/h2-3,8,10-11H,4-7,9H2,1H3/p+1