1-[(3,5-dimethylphenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3,5-dimethylphenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(3,5-dimethylphenyl)-(3-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(3,5-dimethylphenyl)-(3-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3,5-dimethylphenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(3,5-dimethylphenyl)-(3-methyl-2-thienyl)methyl]-1,4-diazepane Formula: C19H26N2S MolecularWeight: 314.48814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2S/c1-14-11-15(2)13-17(12-14)18(19-16(3)5-10-22-19)21-8-4-6-20-7-9-21/h5,10-13,18,20H,4,6-9H2,1-3H3