1-(4-methylphenyl)-1-methylsulfonyl-3-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylcarbamoyl)urea

Systemtic Name: 1-(4-methylphenyl)-1-methylsulfonyl-3-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylcarbamoyl)urea Openeye Name: 1-methylsulfonyl-1-(p-tolyl)-3-(5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-ylcarbamoyl)urea CAS Name: 1-(4-methylphenyl)-1-methylsulfonyl-3-[oxo-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylamino)methyl]urea IUPAC Name: 1-(4-methylphenyl)-1-methylsulfonyl-3-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylcarbamoyl)urea Traditional Name: 1-mesyl-1-(p-tolyl)-3-(5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-ylcarbamoyl)urea Formula: C20H21N5O4S2 MolecularWeight: 459.54184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(=O)NC(=O)NC2=C3C4=C(CCCC4)SC3=NC=N2)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C(=O)NC(=O)NC2=C3C4=C(CCCC4)SC3=NC=N2)S(=O)(=O)C

InChI

InChI=1S/C20H21N5O4S2/c1-12-7-9-13(10-8-12)25(31(2,28)29)20(27)24-19(26)23-17-16-14-5-3-4-6-15(14)30-18(16)22-11-21-17/h7-11H,3-6H2,1-2H3,(H2,21,22,23,24,26,27)