1-[(4-ethylsulfanylphenyl)methyl]-4-(thiophen-3-ylmethyl)-1,4-diazepane

Systemtic Name: 1-[(4-ethylsulfanylphenyl)methyl]-4-(thiophen-3-ylmethyl)-1,4-diazepane Openeye Name: 1-[(4-ethylsulfanylphenyl)methyl]-4-(3-thienylmethyl)-1,4-diazepane CAS Name: 1-[[4-(ethylthio)phenyl]methyl]-4-(3-thiophenylmethyl)-1,4-diazepane IUPAC Name: 1-[(4-ethylsulfanylphenyl)methyl]-4-(thiophen-3-ylmethyl)-1,4-diazepane Traditional Name: 1-[4-(ethylthio)benzyl]-4-(3-thenyl)-1,4-diazepane Formula: C19H26N2S2 MolecularWeight: 346.55314

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)CN2CCCN(CC2)CC3=CSC=C3

Isomeric SMILES

CCSC1=CC=C(C=C1)CN2CCCN(CC2)CC3=CSC=C3

InChI

InChI=1S/C19H26N2S2/c1-2-23-19-6-4-17(5-7-19)14-20-9-3-10-21(12-11-20)15-18-8-13-22-16-18/h4-8,13,16H,2-3,9-12,14-15H2,1H3