(2-iodanylphenyl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (2-iodanylphenyl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (2-iodophenyl)-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (2-iodophenyl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (2-iodophenyl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (2-iodophenyl)-[4-(2-thenyl)-1,4-diazepan-1-yl]methanone Formula: C17H19IN2OS MolecularWeight: 426.31503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC=CC=C2I)CC3=CC=CS3

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC=CC=C2I)CC3=CC=CS3

InChI

InChI=1S/C17H19IN2OS/c18-16-7-2-1-6-15(16)17(21)20-9-4-8-19(10-11-20)13-14-5-3-12-22-14/h1-3,5-7,12H,4,8-11,13H2