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

Systemtic Name: N-[2-(4-ethylpiperazin-1-yl)phenyl]-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[2-(4-ethylpiperazin-1-yl)phenyl]-3-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[2-(4-ethyl-1-piperazinyl)phenyl]-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[2-(4-ethylpiperazin-1-yl)phenyl]-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[2-(4-ethylpiperazino)phenyl]-4-keto-3-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C

InChI

InChI=1S/C22H25N5O2S/c1-3-26-10-12-27(13-11-26)19-7-5-4-6-17(19)23-20(28)15-8-9-16-18(14-15)24-22(30)25(2)21(16)29/h4-9,14H,3,10-13H2,1-2H3,(H,23,28)(H,24,30)