[4-[(3,4-dichlorophenyl)methyl]-1,4-diazepan-1-yl]-thiophen-3-yl-methanone

Systemtic Name: [4-[(3,4-dichlorophenyl)methyl]-1,4-diazepan-1-yl]-thiophen-3-yl-methanone Openeye Name: [4-[(3,4-dichlorophenyl)methyl]-1,4-diazepan-1-yl]-(3-thienyl)methanone CAS Name: [4-[(3,4-dichlorophenyl)methyl]-1,4-diazepan-1-yl]-(3-thiophenyl)methanone IUPAC Name: [4-[(3,4-dichlorophenyl)methyl]-1,4-diazepan-1-yl]-thiophen-3-ylmethanone Traditional Name: [4-(3,4-dichlorobenzyl)-1,4-diazepan-1-yl]-(3-thienyl)methanone Formula: C17H18Cl2N2OS MolecularWeight: 369.30862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CSC=C2)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CSC=C2)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H18Cl2N2OS/c18-15-3-2-13(10-16(15)19)11-20-5-1-6-21(8-7-20)17(22)14-4-9-23-12-14/h2-4,9-10,12H,1,5-8,11H2