methyl 2-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxylate Openeye Name: methyl 2-[2-[methyl(2-thienylmethyl)amino]-2-oxo-ethyl]sulfanyl-4-oxo-3-phenethyl-quinazoline-7-carboxylate CAS Name: 2-[[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]thio]-4-oxo-3-phenethyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]sulfanyl-4-oxo-3-phenethylquinazoline-7-carboxylate Traditional Name: 4-keto-2-[[2-keto-2-[methyl(2-thenyl)amino]ethyl]thio]-3-phenethyl-quinazoline-7-carboxylic acid methyl ester Formula: C26H25N3O4S2 MolecularWeight: 507.6244

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CS1)C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=CS1)C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O4S2/c1-28(16-20-9-6-14-34-20)23(30)17-35-26-27-22-15-19(25(32)33-2)10-11-21(22)24(31)29(26)13-12-18-7-4-3-5-8-18/h3-11,14-15H,12-13,16-17H2,1-2H3