1-[(4-methylsulfanylphenyl)-naphthalen-1-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(4-methylsulfanylphenyl)-naphthalen-1-yl-methyl]-1,4-diazepane Openeye Name: 1-[(4-methylsulfanylphenyl)-(1-naphthyl)methyl]-1,4-diazepane CAS Name: 1-[[4-(methylthio)phenyl]-(1-naphthalenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-methylsulfanylphenyl)-naphthalen-1-ylmethyl]-1,4-diazepane Traditional Name: 1-[[4-(methylthio)phenyl]-(1-naphthyl)methyl]-1,4-diazepane Formula: C23H26N2S MolecularWeight: 362.53094

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCNCC4

Isomeric SMILES

CSC1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCNCC4

InChI

InChI=1S/C23H26N2S/c1-26-20-12-10-19(11-13-20)23(25-16-5-14-24-15-17-25)22-9-4-7-18-6-2-3-8-21(18)22/h2-4,6-13,23-24H,5,14-17H2,1H3