7-[4-(2-chloroethylsulfanylmethyl)phenyl]benzo[a]anthracene

Systemtic Name: 7-[4-(2-chloroethylsulfanylmethyl)phenyl]benzo[a]anthracene Openeye Name: 7-[4-(2-chloroethylsulfanylmethyl)phenyl]benzo[a]anthracene CAS Name: 7-[4-[(2-chloroethylthio)methyl]phenyl]benzo[a]anthracene IUPAC Name: 7-[4-(2-chloroethylsulfanylmethyl)phenyl]benzo[a]anthracene Traditional Name: 7-[4-[(2-chloroethylthio)methyl]phenyl]benz[a]anthracene Formula: C27H21ClS MolecularWeight: 412.97364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)C5=CC=C(C=C5)CSCCCl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)C5=CC=C(C=C5)CSCCCl

InChI

InChI=1S/C27H21ClS/c28-15-16-29-18-19-9-11-21(12-10-19)27-24-8-4-2-6-22(24)17-26-23-7-3-1-5-20(23)13-14-25(26)27/h1-14,17H,15-16,18H2