1-[(5-ethylthiophen-2-yl)-naphthalen-1-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(5-ethylthiophen-2-yl)-naphthalen-1-yl-methyl]-1,4-diazepane Openeye Name: 1-[(5-ethyl-2-thienyl)-(1-naphthyl)methyl]-1,4-diazepane CAS Name: 1-[(5-ethyl-2-thiophenyl)-(1-naphthalenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-ethylthiophen-2-yl)-naphthalen-1-ylmethyl]-1,4-diazepane Traditional Name: 1-[(5-ethyl-2-thienyl)-(1-naphthyl)methyl]-1,4-diazepane Formula: C22H26N2S MolecularWeight: 350.52024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CC=CC3=CC=CC=C32)N4CCCNCC4

Isomeric SMILES

CCC1=CC=C(S1)C(C2=CC=CC3=CC=CC=C32)N4CCCNCC4

InChI

InChI=1S/C22H26N2S/c1-2-18-11-12-21(25-18)22(24-15-6-13-23-14-16-24)20-10-5-8-17-7-3-4-9-19(17)20/h3-5,7-12,22-23H,2,6,13-16H2,1H3