3-methyl-4-oxidanylidene-N-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[(4-isopropylphenyl)-(2-thienyl)methyl]-3-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-methyl-4-oxo-N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-methyl-4-oxo-N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-3-methyl-N-[p-cumenyl(2-thienyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H23N3O2S2 MolecularWeight: 449.58832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C

InChI

InChI=1S/C24H23N3O2S2/c1-14(2)15-6-8-16(9-7-15)21(20-5-4-12-31-20)26-22(28)17-10-11-18-19(13-17)25-24(30)27(3)23(18)29/h4-14,21H,1-3H3,(H,25,30)(H,26,28)