ethyl 2-[2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanylethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanylethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanylacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(8-ethyl-2-phenyl-4-quinazolinyl)thio]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(8-ethyl-2-phenylquinazolin-4-yl)sulfanylacetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[(8-ethyl-2-phenyl-quinazolin-4-yl)thio]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H27N3O3S2 MolecularWeight: 505.65158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC3=C(C(=C(S3)C)C)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC3=C(C(=C(S3)C)C)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O3S2/c1-5-18-13-10-14-20-23(18)29-24(19-11-8-7-9-12-19)30-25(20)34-15-21(31)28-26-22(27(32)33-6-2)16(3)17(4)35-26/h7-14H,5-6,15H2,1-4H3,(H,28,31)