1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-methyl-2-(2-methylprop-2-enyl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-methyl-2-(2-methylprop-2-enyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-3-methyl-2-(2-methylallyl)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-methyl-2-(2-methylprop-2-enyl)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-3-methyl-2-(2-methylprop-2-enyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-3-methyl-2-(2-methylallyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C25H24BrN5O2S2 MolecularWeight: 570.52436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC(=C)C)N4CCN(CC4)S(=O)(=O)C5=CC=C(S5)Br)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC(=C)C)N4CCN(CC4)S(=O)(=O)C5=CC=C(S5)Br)C#N

InChI

InChI=1S/C25H24BrN5O2S2/c1-16(2)14-18-17(3)19(15-27)24-28-20-6-4-5-7-21(20)31(24)25(18)29-10-12-30(13-11-29)35(32,33)23-9-8-22(26)34-23/h4-9H,1,10-14H2,2-3H3