1-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)-3-pyridin-3-yl-thiourea

Systemtic Name: 1-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)-3-pyridin-3-yl-thiourea Openeye Name: 1-[5-morpholinosulfonyl-2-(1-piperidyl)phenyl]-3-(3-pyridyl)thiourea CAS Name: 1-[5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)phenyl]-3-(3-pyridinyl)thiourea IUPAC Name: 1-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)-3-pyridin-3-ylthiourea Traditional Name: 1-(5-morpholinosulfonyl-2-piperidino-phenyl)-3-(3-pyridyl)thiourea Formula: C21H27N5O3S2 MolecularWeight: 461.60078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NC4=CN=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NC4=CN=CC=C4

InChI

InChI=1S/C21H27N5O3S2/c27-31(28,26-11-13-29-14-12-26)18-6-7-20(25-9-2-1-3-10-25)19(15-18)24-21(30)23-17-5-4-8-22-16-17/h4-8,15-16H,1-3,9-14H2,(H2,23,24,30)