4-chloranyl-N-[1-(phenylmethyl)piperidin-4-yl]-3-phenylsulfanyl-quinolin-2-amine

Systemtic Name: 4-chloranyl-N-[1-(phenylmethyl)piperidin-4-yl]-3-phenylsulfanyl-quinolin-2-amine Openeye Name: N-(1-benzyl-4-piperidyl)-4-chloro-3-phenylsulfanyl-quinolin-2-amine CAS Name: 4-chloro-N-[1-(phenylmethyl)-4-piperidinyl]-3-(phenylthio)-2-quinolinamine IUPAC Name: N-(1-benzylpiperidin-4-yl)-4-chloro-3-phenylsulfanylquinolin-2-amine Traditional Name: (1-benzyl-4-piperidyl)-[4-chloro-3-(phenylthio)-2-quinolyl]amine Formula: C27H26ClN3S MolecularWeight: 460.03344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC3=CC=CC=C3C(=C2SC4=CC=CC=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC2=NC3=CC=CC=C3C(=C2SC4=CC=CC=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C27H26ClN3S/c28-25-23-13-7-8-14-24(23)30-27(26(25)32-22-11-5-2-6-12-22)29-21-15-17-31(18-16-21)19-20-9-3-1-4-10-20/h1-14,21H,15-19H2,(H,29,30)