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

Systemtic Name: N-cyclopropyl-3-(3-methoxypropyl)-4-oxidanylidene-N-(phenylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-benzyl-N-cyclopropyl-3-(3-methoxypropyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-cyclopropyl-3-(3-methoxypropyl)-4-oxo-N-(phenylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-benzyl-N-cyclopropyl-3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-benzyl-N-cyclopropyl-4-keto-3-(3-methoxypropyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N(CC3=CC=CC=C3)C4CC4)NC1=S

Isomeric SMILES

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N(CC3=CC=CC=C3)C4CC4)NC1=S

InChI

InChI=1S/C23H25N3O3S/c1-29-13-5-12-25-22(28)19-11-8-17(14-20(19)24-23(25)30)21(27)26(18-9-10-18)15-16-6-3-2-4-7-16/h2-4,6-8,11,14,18H,5,9-10,12-13,15H2,1H3,(H,24,30)