N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-3-(3-methoxypropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-3-(3-methoxypropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-3-(3-methoxypropyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[3-(cyclopropanecarbonylamino)benzyl]-4-keto-3-(3-methoxypropyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4)NC1=S

Isomeric SMILES

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4)NC1=S

InChI

InChI=1S/C24H26N4O4S/c1-32-11-3-10-28-23(31)19-9-8-17(13-20(19)27-24(28)33)21(29)25-14-15-4-2-5-18(12-15)26-22(30)16-6-7-16/h2,4-5,8-9,12-13,16H,3,6-7,10-11,14H2,1H3,(H,25,29)(H,26,30)(H,27,33)