[1-[(2-azanylpyridin-4-yl)methyl]piperidin-4-yl]-[4-(5-pyridin-2-ylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [1-[(2-azanylpyridin-4-yl)methyl]piperidin-4-yl]-[4-(5-pyridin-2-ylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone Openeye Name: [1-[(2-amino-4-pyridyl)methyl]-4-piperidyl]-[4-[[5-(2-pyridyl)-2-thienyl]sulfonyl]piperazin-1-yl]methanone CAS Name: [1-[(2-amino-4-pyridinyl)methyl]-4-piperidinyl]-[4-[[5-(2-pyridinyl)-2-thiophenyl]sulfonyl]-1-piperazinyl]methanone IUPAC Name: [1-[(2-aminopyridin-4-yl)methyl]piperidin-4-yl]-[4-(5-pyridin-2-ylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone Traditional Name: [1-[(2-amino-4-pyridyl)methyl]-4-piperidyl]-[4-[[5-(2-pyridyl)-2-thienyl]sulfonyl]piperazino]methanone Formula: C25H30N6O3S2 MolecularWeight: 526.6741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C4=CC=CC=N4)CC5=CC(=NC=C5)N

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C4=CC=CC=N4)CC5=CC(=NC=C5)N

InChI

InChI=1S/C25H30N6O3S2/c26-23-17-19(6-10-28-23)18-29-11-7-20(8-12-29)25(32)30-13-15-31(16-14-30)36(33,34)24-5-4-22(35-24)21-3-1-2-9-27-21/h1-6,9-10,17,20H,7-8,11-16,18H2,(H2,26,28)