2-[3-(7-methyloctyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: 2-[3-(7-methyloctyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Openeye Name: 2-[3-(7-methyloctyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide CAS Name: 2-[[3-(7-methyloctyl)-4-oxo-2-quinazolinyl]thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 2-[3-(7-methyloctyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Traditional Name: 2-[[4-keto-3-(7-methyloctyl)quinazolin-2-yl]thio]-N-(4-sulfamoylphenyl)propionamide Formula: C26H34N4O4S2 MolecularWeight: 530.70256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC(C)CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C26H34N4O4S2/c1-18(2)10-6-4-5-9-17-30-25(32)22-11-7-8-12-23(22)29-26(30)35-19(3)24(31)28-20-13-15-21(16-14-20)36(27,33)34/h7-8,11-16,18-19H,4-6,9-10,17H2,1-3H3,(H,28,31)(H2,27,33,34)