4-[(6-bromanyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[3-(4-ethylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 4-[(6-bromanyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[3-(4-ethylpiperazin-1-yl)propyl]benzamide Openeye Name: 4-[(6-bromo-4-oxo-2-thioxo-1H-quinazolin-3-yl)methyl]-N-[3-(4-ethylpiperazin-1-yl)propyl]benzamide CAS Name: 4-[(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[3-(4-ethyl-1-piperazinyl)propyl]benzamide IUPAC Name: 4-[(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[3-(4-ethylpiperazin-1-yl)propyl]benzamide Traditional Name: 4-[(6-bromo-4-keto-2-thioxo-1H-quinazolin-3-yl)methyl]-N-[3-(4-ethylpiperazino)propyl]benzamide Formula: C25H30BrN5O2S MolecularWeight: 544.507

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=C(C=CC(=C4)Br)NC3=S

Isomeric SMILES

CCN1CCN(CC1)CCCNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=C(C=CC(=C4)Br)NC3=S

InChI

InChI=1S/C25H30BrN5O2S/c1-2-29-12-14-30(15-13-29)11-3-10-27-23(32)19-6-4-18(5-7-19)17-31-24(33)21-16-20(26)8-9-22(21)28-25(31)34/h4-9,16H,2-3,10-15,17H2,1H3,(H,27,32)(H,28,34)