3-[4-(4-naphthalen-1-ylpiperazin-1-yl)-4-oxidanylidene-butyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[4-(4-naphthalen-1-ylpiperazin-1-yl)-4-oxidanylidene-butyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[4-[4-(1-naphthyl)piperazin-1-yl]-4-oxo-butyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[4-[4-(1-naphthalenyl)-1-piperazinyl]-4-oxobutyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[4-(4-naphthalen-1-ylpiperazin-1-yl)-4-oxobutyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[4-keto-4-[4-(1-naphthyl)piperazino]butyl]-2-thioxo-1H-quinazolin-4-one Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC3=CC=CC=C32)C(=O)CCCN4C(=O)C5=CC=CC=C5NC4=S

Isomeric SMILES

C1CN(CCN1C2=CC=CC3=CC=CC=C32)C(=O)CCCN4C(=O)C5=CC=CC=C5NC4=S

InChI

InChI=1S/C26H26N4O2S/c31-24(13-6-14-30-25(32)21-10-3-4-11-22(21)27-26(30)33)29-17-15-28(16-18-29)23-12-5-8-19-7-1-2-9-20(19)23/h1-5,7-12H,6,13-18H2,(H,27,33)