1-(naphthalen-1-ylmethylsulfanyl)-3-propyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-(naphthalen-1-ylmethylsulfanyl)-3-propyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-(1-naphthylmethylsulfanyl)-3-propyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-(1-naphthalenylmethylthio)-3-propyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-(naphthalen-1-ylmethylsulfanyl)-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(1-naphthylmethylthio)-3-propyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C26H21N3S MolecularWeight: 407.53004

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC=CC5=CC=CC=C54)C#N

Isomeric SMILES

CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC=CC5=CC=CC=C54)C#N

InChI

InChI=1S/C26H21N3S/c1-2-8-19-15-25(30-17-20-11-7-10-18-9-3-4-12-21(18)20)29-24-14-6-5-13-23(24)28-26(29)22(19)16-27/h3-7,9-15H,2,8,17H2,1H3