1-(3-methoxypropyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea

Systemtic Name: 1-(3-methoxypropyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Openeye Name: 1-(3-methoxypropyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea CAS Name: 1-(3-methoxypropyl)-3-[4-[(6-methoxy-4-pyrimidinyl)sulfamoyl]phenyl]thiourea IUPAC Name: 1-(3-methoxypropyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Traditional Name: 1-(3-methoxypropyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Formula: C16H21N5O4S2 MolecularWeight: 411.49904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=NC=N2)OC

Isomeric SMILES

COCCCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=NC=N2)OC

InChI

InChI=1S/C16H21N5O4S2/c1-24-9-3-8-17-16(26)20-12-4-6-13(7-5-12)27(22,23)21-14-10-15(25-2)19-11-18-14/h4-7,10-11H,3,8-9H2,1-2H3,(H2,17,20,26)(H,18,19,21)