1-[(2,4-dichlorophenyl)-thiophen-3-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(2,4-dichlorophenyl)-thiophen-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(2,4-dichlorophenyl)-(3-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(2,4-dichlorophenyl)-(3-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2,4-dichlorophenyl)-thiophen-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[(2,4-dichlorophenyl)-(3-thienyl)methyl]-1,4-diazepane Formula: C16H18Cl2N2S MolecularWeight: 341.29852

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CSC=C2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CNCCN(C1)C(C2=CSC=C2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H18Cl2N2S/c17-13-2-3-14(15(18)10-13)16(12-4-9-21-11-12)20-7-1-5-19-6-8-20/h2-4,9-11,16,19H,1,5-8H2