N-(4-chlorophenyl)-4-pyridin-4-ylsulfanyl-isoquinolin-1-amine

Systemtic Name: N-(4-chlorophenyl)-4-pyridin-4-ylsulfanyl-isoquinolin-1-amine Openeye Name: N-(4-chlorophenyl)-4-(4-pyridylsulfanyl)isoquinolin-1-amine CAS Name: N-(4-chlorophenyl)-4-(pyridin-4-ylthio)-1-isoquinolinamine IUPAC Name: N-(4-chlorophenyl)-4-pyridin-4-ylsulfanylisoquinolin-1-amine Traditional Name: (4-chlorophenyl)-[4-(4-pyridylthio)-1-isoquinolyl]amine Formula: C20H14ClN3S MolecularWeight: 363.86326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN=C2NC3=CC=C(C=C3)Cl)SC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN=C2NC3=CC=C(C=C3)Cl)SC4=CC=NC=C4

InChI

InChI=1S/C20H14ClN3S/c21-14-5-7-15(8-6-14)24-20-18-4-2-1-3-17(18)19(13-23-20)25-16-9-11-22-12-10-16/h1-13H,(H,23,24)