3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propanamide

Systemtic Name: 3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propanamide Openeye Name: 3-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]propanamide CAS Name: 3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propanamide IUPAC Name: 3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propanamide Traditional Name: 3-[4-(2-thenyl)-1,4-diazepan-1-yl]propionamide Formula: C13H21N3OS MolecularWeight: 267.39034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC2=CC=CS2)CCC(=O)N

Isomeric SMILES

C1CN(CCN(C1)CC2=CC=CS2)CCC(=O)N

InChI

InChI=1S/C13H21N3OS/c14-13(17)4-7-15-5-2-6-16(9-8-15)11-12-3-1-10-18-12/h1,3,10H,2,4-9,11H2,(H2,14,17)