2-[4-[(3-chloranyl-1-benzothiophen-2-yl)methyl]-1,4-diazepan-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[(3-chloranyl-1-benzothiophen-2-yl)methyl]-1,4-diazepan-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[(3-chlorobenzothiophen-2-yl)methyl]-1,4-diazepan-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[(3-chloro-1-benzothiophen-2-yl)methyl]-1,4-diazepan-1-yl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[(3-chloro-1-benzothiophen-2-yl)methyl]-1,4-diazepan-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[(3-chlorobenzothiophen-2-yl)methyl]-1,4-diazepan-1-yl]-N-isopropyl-acetamide Formula: C19H26ClN3OS MolecularWeight: 379.94724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CCCN(CC1)CC2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC(C)NC(=O)CN1CCCN(CC1)CC2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C19H26ClN3OS/c1-14(2)21-18(24)13-23-9-5-8-22(10-11-23)12-17-19(20)15-6-3-4-7-16(15)25-17/h3-4,6-7,14H,5,8-13H2,1-2H3,(H,21,24)