azepan-1-yl-[1-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(3-chlorobenzothiophene-2-carbonyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(3-chloro-1-benzothiophene-2-carbonyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(3-chlorobenzothiophene-2-carbonyl)-4-piperidyl]methanone Formula: C21H25ClN2O2S MolecularWeight: 404.9534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H25ClN2O2S/c22-18-16-7-3-4-8-17(16)27-19(18)21(26)24-13-9-15(10-14-24)20(25)23-11-5-1-2-6-12-23/h3-4,7-8,15H,1-2,5-6,9-14H2