2-(4-cyclohexylpiperazin-1-yl)-5-[2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]pyrrol-1-yl]-1,3,4-thiadiazole

Systemtic Name: 2-(4-cyclohexylpiperazin-1-yl)-5-[2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]pyrrol-1-yl]-1,3,4-thiadiazole Openeye Name: 2-(4-cyclohexylpiperazin-1-yl)-5-[2-[[4-(1-piperidyl)-1-piperidyl]methyl]pyrrol-1-yl]-1,3,4-thiadiazole CAS Name: 2-(4-cyclohexyl-1-piperazinyl)-5-[2-[[4-(1-piperidinyl)-1-piperidinyl]methyl]-1-pyrrolyl]-1,3,4-thiadiazole IUPAC Name: 2-(4-cyclohexylpiperazin-1-yl)-5-[2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]pyrrol-1-yl]-1,3,4-thiadiazole Traditional Name: 2-(4-cyclohexylpiperazino)-5-[2-[(4-piperidinopiperidino)methyl]pyrrol-1-yl]-1,3,4-thiadiazole Formula: C27H43N7S MolecularWeight: 497.74222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C3=NN=C(S3)N4C=CC=C4CN5CCC(CC5)N6CCCCC6

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C3=NN=C(S3)N4C=CC=C4CN5CCC(CC5)N6CCCCC6

InChI

InChI=1S/C27H43N7S/c1-3-8-23(9-4-1)32-18-20-33(21-19-32)26-28-29-27(35-26)34-15-7-10-25(34)22-30-16-11-24(12-17-30)31-13-5-2-6-14-31/h7,10,15,23-24H,1-6,8-9,11-14,16-22H2