1-[(5-methylthiophen-2-yl)-(4-propan-2-ylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-methylthiophen-2-yl)-(4-propan-2-ylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(4-isopropylphenyl)-(5-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(5-methyl-2-thiophenyl)-(4-propan-2-ylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-methylthiophen-2-yl)-(4-propan-2-ylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-methyl-2-thienyl)-p-cumenyl-methyl]-1,4-diazepane Formula: C20H28N2S MolecularWeight: 328.51472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2=CC=C(C=C2)C(C)C)N3CCCNCC3

Isomeric SMILES

CC1=CC=C(S1)C(C2=CC=C(C=C2)C(C)C)N3CCCNCC3

InChI

InChI=1S/C20H28N2S/c1-15(2)17-6-8-18(9-7-17)20(19-10-5-16(3)23-19)22-13-4-11-21-12-14-22/h5-10,15,20-21H,4,11-14H2,1-3H3