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

Systemtic Name: 1-[(3-methylphenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(3-methyl-2-thienyl)-(m-tolyl)methyl]-1,4-diazepane CAS Name: 1-[(3-methylphenyl)-(3-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-methylphenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(3-methyl-2-thienyl)-(m-tolyl)methyl]-1,4-diazepane Formula: C18H24N2S MolecularWeight: 300.46156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=C(C=CS2)C)N3CCCNCC3

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=C(C=CS2)C)N3CCCNCC3

InChI

InChI=1S/C18H24N2S/c1-14-5-3-6-16(13-14)17(18-15(2)7-12-21-18)20-10-4-8-19-9-11-20/h3,5-7,12-13,17,19H,4,8-11H2,1-2H3