1-methyl-10-(6-pyrrolidin-1-ylhexyl)-5H-thieno[3,4-b][1,5]benzodiazepin-4-one

Systemtic Name: 1-methyl-10-(6-pyrrolidin-1-ylhexyl)-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Openeye Name: 1-methyl-10-(6-pyrrolidin-1-ylhexyl)-5H-thieno[3,4-b][1,5]benzodiazepin-4-one CAS Name: 1-methyl-10-[6-(1-pyrrolidinyl)hexyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one IUPAC Name: 1-methyl-10-(6-pyrrolidin-1-ylhexyl)-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Traditional Name: 1-methyl-10-(6-pyrrolidinohexyl)-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2CCCCCCN4CCCC4

Isomeric SMILES

CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2CCCCCCN4CCCC4

InChI

InChI=1S/C22H29N3OS/c1-17-21-18(16-27-17)22(26)23-19-10-4-5-11-20(19)25(21)15-7-3-2-6-12-24-13-8-9-14-24/h4-5,10-11,16H,2-3,6-9,12-15H2,1H3,(H,23,26)