1-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(4-isopropylphenyl)-(2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]-1,4-diazepane IUPAC Name: 1-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[p-cumenyl(2-thienyl)methyl]-1,4-diazepane Formula: C19H26N2S MolecularWeight: 314.48814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)N3CCCNCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)N3CCCNCC3

InChI

InChI=1S/C19H26N2S/c1-15(2)16-6-8-17(9-7-16)19(18-5-3-14-22-18)21-12-4-10-20-11-13-21/h3,5-9,14-15,19-20H,4,10-13H2,1-2H3