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

Systemtic Name: 3-[4-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[4-[4-(1-naphthylmethyl)piperazin-1-yl]-4-oxo-butyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[4-[4-(1-naphthalenylmethyl)-1-piperazinyl]-4-oxobutyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[4-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-4-oxobutyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[4-keto-4-[4-(1-naphthylmethyl)piperazino]butyl]-2-thioxo-1H-quinazolin-4-one Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(=O)CCCN4C(=O)C5=CC=CC=C5NC4=S

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(=O)CCCN4C(=O)C5=CC=CC=C5NC4=S

InChI

InChI=1S/C27H28N4O2S/c32-25(13-6-14-31-26(33)23-11-3-4-12-24(23)28-27(31)34)30-17-15-29(16-18-30)19-21-9-5-8-20-7-1-2-10-22(20)21/h1-5,7-12H,6,13-19H2,(H,28,34)