[4-[(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-cyclopropyl-methanone

Systemtic Name: [4-[(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-cyclopropyl-methanone Openeye Name: [4-(5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)piperazin-1-yl]-cyclopropyl-methanone CAS Name: [4-[(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]-cyclopropylmethanone IUPAC Name: [4-(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)piperazin-1-yl]-cyclopropylmethanone Traditional Name: [4-(5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)piperazino]-cyclopropyl-methanone Formula: C21H30N2O2S MolecularWeight: 374.5401

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C21H30N2O2S/c1-21(2,3)16-6-7-17-15(12-16)13-18(26-17)20(25)23-10-8-22(9-11-23)19(24)14-4-5-14/h13-14,16H,4-12H2,1-3H3