1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-(2-methyl-4-oxo-quinazolin-3-yl)-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-(2-methyl-4-oxo-3-quinazolinyl)-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(2-methyl-4-oxoquinazolin-3-yl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(4-keto-2-methyl-quinazolin-3-yl)-3-(4-morpholinosulfonylphenyl)thiourea Formula: C20H21N5O4S2 MolecularWeight: 459.54184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H21N5O4S2/c1-14-21-18-5-3-2-4-17(18)19(26)25(14)23-20(30)22-15-6-8-16(9-7-15)31(27,28)24-10-12-29-13-11-24/h2-9H,10-13H2,1H3,(H2,22,23,30)