1-methyl-10-[6-(4-phenethylpiperazin-1-yl)hex-4-ynyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one

Systemtic Name: 1-methyl-10-[6-(4-phenethylpiperazin-1-yl)hex-4-ynyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Openeye Name: 1-methyl-10-[6-(4-phenethylpiperazin-1-yl)hex-4-ynyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one CAS Name: 1-methyl-10-[6-(4-phenethyl-1-piperazinyl)hex-4-ynyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one IUPAC Name: 1-methyl-10-[6-(4-phenethylpiperazin-1-yl)hex-4-ynyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Traditional Name: 1-methyl-10-[6-(4-phenethylpiperazino)hex-4-ynyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Formula: C30H34N4OS MolecularWeight: 498.68216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2CCCC#CCN4CCN(CC4)CCC5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2CCCC#CCN4CCN(CC4)CCC5=CC=CC=C5

InChI

InChI=1S/C30H34N4OS/c1-24-29-26(23-36-24)30(35)31-27-13-7-8-14-28(27)34(29)17-10-3-2-9-16-32-19-21-33(22-20-32)18-15-25-11-5-4-6-12-25/h4-8,11-14,23H,3,10,15-22H2,1H3,(H,31,35)