[3-(piperidin-1-ylmethyl)-1-benzothiophen-6-yl]-(4-propan-2-ylpiperazin-1-yl)methanone

Systemtic Name: [3-(piperidin-1-ylmethyl)-1-benzothiophen-6-yl]-(4-propan-2-ylpiperazin-1-yl)methanone Openeye Name: (4-isopropylpiperazin-1-yl)-[3-(1-piperidylmethyl)benzothiophen-6-yl]methanone CAS Name: [3-(1-piperidinylmethyl)-1-benzothiophen-6-yl]-(4-propan-2-yl-1-piperazinyl)methanone IUPAC Name: [3-(piperidin-1-ylmethyl)-1-benzothiophen-6-yl]-(4-propan-2-ylpiperazin-1-yl)methanone Traditional Name: (4-isopropylpiperazino)-[3-(piperidinomethyl)benzothiophen-6-yl]methanone Formula: C22H31N3OS MolecularWeight: 385.56604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=CS3)CN4CCCCC4

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=CS3)CN4CCCCC4

InChI

InChI=1S/C22H31N3OS/c1-17(2)24-10-12-25(13-11-24)22(26)18-6-7-20-19(16-27-21(20)14-18)15-23-8-4-3-5-9-23/h6-7,14,16-17H,3-5,8-13,15H2,1-2H3