N-(oxolan-2-ylmethyl)-2-(11H-pyrido[2,3-b][1,4]benzodiazepin-6-ylsulfanyl)ethanamide

Systemtic Name: N-(oxolan-2-ylmethyl)-2-(11H-pyrido[2,3-b][1,4]benzodiazepin-6-ylsulfanyl)ethanamide Openeye Name: 2-(11H-pyrido[2,3-b][1,4]benzodiazepin-6-ylsulfanyl)-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: N-(2-oxolanylmethyl)-2-(11H-pyrido[2,3-b][1,4]benzodiazepin-6-ylthio)acetamide IUPAC Name: N-(oxolan-2-ylmethyl)-2-(11H-pyrido[2,3-b][1,4]benzodiazepin-6-ylsulfanyl)acetamide Traditional Name: 2-(11H-pyrido[2,3-b][1,4]benzodiazepin-6-ylthio)-N-(tetrahydrofurfuryl)acetamide Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CSC2=NC3=C(NC4=CC=CC=C42)N=CC=C3

Isomeric SMILES

C1CC(OC1)CNC(=O)CSC2=NC3=C(NC4=CC=CC=C42)N=CC=C3

InChI

InChI=1S/C19H20N4O2S/c24-17(21-11-13-5-4-10-25-13)12-26-19-14-6-1-2-7-15(14)22-18-16(23-19)8-3-9-20-18/h1-3,6-9,13H,4-5,10-12H2,(H,20,22)(H,21,24)