4,5,6-trimethyl-2-[(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 4,5,6-trimethyl-2-[(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 4,5,6-trimethyl-2-[(5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methylsulfanyl]pyridine-3-carbonitrile CAS Name: 4,5,6-trimethyl-2-[[5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]methylthio]-3-pyridinecarbonitrile IUPAC Name: 4,5,6-trimethyl-2-[(5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 4,5,6-trimethyl-2-[(5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methylthio]nicotinonitrile Formula: C24H29N5O3S2 MolecularWeight: 499.64876

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC(=C(C(=C4C#N)C)C)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC(=C(C(=C4C#N)C)C)C

InChI

InChI=1S/C24H29N5O3S2/c1-5-8-29-22-7-6-19(34(30,31)28-9-11-32-12-10-28)13-21(22)27-23(29)15-33-24-20(14-25)17(3)16(2)18(4)26-24/h6-7,13H,5,8-12,15H2,1-4H3