1-methyl-10-(2-piperazin-1-ylethanoyl)-5H-thieno[3,4-b][1,5]benzodiazepin-4-one

Systemtic Name: 1-methyl-10-(2-piperazin-1-ylethanoyl)-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Openeye Name: 1-methyl-10-(2-piperazin-1-ylacetyl)-5H-thieno[3,4-b][1,5]benzodiazepin-4-one CAS Name: 1-methyl-10-[1-oxo-2-(1-piperazinyl)ethyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one IUPAC Name: 1-methyl-10-(2-piperazin-1-ylacetyl)-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Traditional Name: 1-methyl-10-(2-piperazinoacetyl)-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2C(=O)CN4CCNCC4

Isomeric SMILES

CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2C(=O)CN4CCNCC4

InChI

InChI=1S/C18H20N4O2S/c1-12-17-13(11-25-12)18(24)20-14-4-2-3-5-15(14)22(17)16(23)10-21-8-6-19-7-9-21/h2-5,11,19H,6-10H2,1H3,(H,20,24)