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

Systemtic Name: N-(1,2-diphenylethyl)-3-(3-methoxypropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(1,2-diphenylethyl)-3-(3-methoxypropyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(1,2-diphenylethyl)-3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(1,2-diphenylethyl)-3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(1,2-diphenylethyl)-4-keto-3-(3-methoxypropyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C4=CC=CC=C4)NC1=S

Isomeric SMILES

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C4=CC=CC=C4)NC1=S

InChI

InChI=1S/C27H27N3O3S/c1-33-16-8-15-30-26(32)22-14-13-21(18-24(22)29-27(30)34)25(31)28-23(20-11-6-3-7-12-20)17-19-9-4-2-5-10-19/h2-7,9-14,18,23H,8,15-17H2,1H3,(H,28,31)(H,29,34)