N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,6-dimethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-thienylmethyl)acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3,6-dimethyl-4-oxo-2-quinazolinyl)thio]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,6-dimethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-keto-3,6-dimethyl-quinazolin-2-yl)thio]-N-(2-thenyl)acetamide Formula: C25H23N3O4S2 MolecularWeight: 493.59782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N(C2=O)C)SCC(=O)N(CC3=CC=CS3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)C)SCC(=O)N(CC3=CC=CS3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H23N3O4S2/c1-16-5-7-20-19(12-16)24(30)27(2)25(26-20)34-15-23(29)28(14-18-4-3-11-33-18)17-6-8-21-22(13-17)32-10-9-31-21/h3-8,11-13H,9-10,14-15H2,1-2H3