3-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[3-(4-benzyl-1-piperidyl)propyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[3-(4-benzylpiperidin-1-yl)propyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[3-(4-benzylpiperidino)propyl]-2-thioxo-1H-quinazolin-4-one Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCCN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCCN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C23H27N3OS/c27-22-20-9-4-5-10-21(20)24-23(28)26(22)14-6-13-25-15-11-19(12-16-25)17-18-7-2-1-3-8-18/h1-5,7-10,19H,6,11-17H2,(H,24,28)