4-methyl-N-[2-[4-(phenylcarbonyl)-1,4-diazepan-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-methyl-N-[2-[4-(phenylcarbonyl)-1,4-diazepan-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-[2-(4-benzoyl-1,4-diazepan-1-yl)-5-(piperazine-1-carbonyl)phenyl]-4-methyl-thiadiazole-5-carboxamide CAS Name: N-[2-(4-benzoyl-1,4-diazepan-1-yl)-5-[oxo(1-piperazinyl)methyl]phenyl]-4-methyl-5-thiadiazolecarboxamide IUPAC Name: N-[2-(4-benzoyl-1,4-diazepan-1-yl)-5-(piperazine-1-carbonyl)phenyl]-4-methylthiadiazole-5-carboxamide Traditional Name: N-[2-(4-benzoyl-1,4-diazepan-1-yl)-5-(piperazine-1-carbonyl)phenyl]-4-methyl-thiadiazole-5-carboxamide Formula: C27H31N7O3S MolecularWeight: 533.64514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCNCC3)N4CCCN(CC4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(SN=N1)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCNCC3)N4CCCN(CC4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H31N7O3S/c1-19-24(38-31-30-19)25(35)29-22-18-21(27(37)34-14-10-28-11-15-34)8-9-23(22)32-12-5-13-33(17-16-32)26(36)20-6-3-2-4-7-20/h2-4,6-9,18,28H,5,10-17H2,1H3,(H,29,35)