1-[(4-chlorophenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(4-chlorophenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(4-chlorophenyl)-(3-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(4-chlorophenyl)-(3-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-chlorophenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(4-chlorophenyl)-(3-methyl-2-thienyl)methyl]-1,4-diazepane Formula: C17H21ClN2S MolecularWeight: 320.88004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C2=CC=C(C=C2)Cl)N3CCCNCC3

Isomeric SMILES

CC1=C(SC=C1)C(C2=CC=C(C=C2)Cl)N3CCCNCC3

InChI

InChI=1S/C17H21ClN2S/c1-13-7-12-21-17(13)16(14-3-5-15(18)6-4-14)20-10-2-8-19-9-11-20/h3-7,12,16,19H,2,8-11H2,1H3