4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]-N-(phenylcarbonyl)benzamide

Systemtic Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]-N-(phenylcarbonyl)benzamide Openeye Name: N-benzoyl-4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide CAS Name: N-benzoyl-4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-[3-(4-methyl-1-piperazinyl)propyl]benzamide IUPAC Name: N-benzoyl-4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide Traditional Name: N-benzoyl-4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-[3-(4-methylpiperazino)propyl]benzamide Formula: C31H40N6O2S MolecularWeight: 560.7533

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCN(C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)C4=NN(C(=NC5CCCCC5)S4)C

Isomeric SMILES

CN1CCN(CC1)CCCN(C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)C4=NN(C(=NC5CCCCC5)S4)C

InChI

InChI=1S/C31H40N6O2S/c1-34-20-22-36(23-21-34)18-9-19-37(29(38)25-10-5-3-6-11-25)30(39)26-16-14-24(15-17-26)28-33-35(2)31(40-28)32-27-12-7-4-8-13-27/h3,5-6,10-11,14-17,27H,4,7-9,12-13,18-23H2,1-2H3