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

Systemtic Name: 1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-propyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-3-propyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-propyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-3-propyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C23H22BrN5O2S2 MolecularWeight: 544.48708

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)S(=O)(=O)C5=CC=C(S5)Br)C#N

Isomeric SMILES

CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)S(=O)(=O)C5=CC=C(S5)Br)C#N

InChI

InChI=1S/C23H22BrN5O2S2/c1-2-5-16-14-21(29-19-7-4-3-6-18(19)26-23(29)17(16)15-25)27-10-12-28(13-11-27)33(30,31)22-9-8-20(24)32-22/h3-4,6-9,14H,2,5,10-13H2,1H3