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

Systemtic Name: 7-(2-chloroethylsulfanylmethyl)benzo[a]anthracene Openeye Name: 7-(2-chloroethylsulfanylmethyl)benzo[a]anthracene CAS Name: 7-[(2-chloroethylthio)methyl]benzo[a]anthracene IUPAC Name: 7-(2-chloroethylsulfanylmethyl)benzo[a]anthracene Traditional Name: 7-[(2-chloroethylthio)methyl]benz[a]anthracene Formula: C21H17ClS MolecularWeight: 336.87768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClS/c22-11-12-23-14-21-18-8-4-2-6-16(18)13-20-17-7-3-1-5-15(17)9-10-19(20)21/h1-10,13H,11-12,14H2