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

Systemtic Name: 1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-phenethyl-thiourea Openeye Name: 1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-phenethyl-thiourea CAS Name: 1-[4-[(6-methoxy-4-pyrimidinyl)sulfamoyl]phenyl]-3-phenethylthiourea IUPAC Name: 1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-phenethylthiourea Traditional Name: 1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-phenethyl-thiourea Formula: C20H21N5O3S2 MolecularWeight: 443.54244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H21N5O3S2/c1-28-19-13-18(22-14-23-19)25-30(26,27)17-9-7-16(8-10-17)24-20(29)21-12-11-15-5-3-2-4-6-15/h2-10,13-14H,11-12H2,1H3,(H2,21,24,29)(H,22,23,25)