3-(3-methoxypropyl)-4-oxidanylidene-N-(4-phenylmethoxyphenyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(3-methoxypropyl)-4-oxidanylidene-N-(4-phenylmethoxyphenyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(4-benzyloxyphenyl)-3-(3-methoxypropyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(3-methoxypropyl)-4-oxo-N-(4-phenylmethoxyphenyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(3-methoxypropyl)-4-oxo-N-(4-phenylmethoxyphenyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(4-benzoxyphenyl)-4-keto-3-(3-methoxypropyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)NC1=S

Isomeric SMILES

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)NC1=S

InChI

InChI=1S/C26H25N3O4S/c1-32-15-5-14-29-25(31)22-13-8-19(16-23(22)28-26(29)34)24(30)27-20-9-11-21(12-10-20)33-17-18-6-3-2-4-7-18/h2-4,6-13,16H,5,14-15,17H2,1H3,(H,27,30)(H,28,34)