5-(4-chlorophenyl)-4-(4-prop-1-en-2-ylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine

Systemtic Name: 5-(4-chlorophenyl)-4-(4-prop-1-en-2-ylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Openeye Name: 5-(4-chlorophenyl)-4-(4-isopropenylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine CAS Name: 5-(4-chlorophenyl)-4-[4-(1-methylethenyl)-1-piperazin-4-iumyl]thieno[2,3-d]pyrimidine IUPAC Name: 5-(4-chlorophenyl)-4-(4-prop-1-en-2-ylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Traditional Name: 5-(4-chlorophenyl)-4-(4-isopropenylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Formula: C19H20ClN4S+ MolecularWeight: 371.9069

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)[NH+]1CCN(CC1)C2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(=C)[NH+]1CCN(CC1)C2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H19ClN4S/c1-13(2)23-7-9-24(10-8-23)18-17-16(11-25-19(17)22-12-21-18)14-3-5-15(20)6-4-14/h3-6,11-12H,1,7-10H2,2H3/p+1