4-[3-(4-tert-butylcyclohexyl)-4-(4-butylpiperazin-1-yl)phenyl]thiomorpholine hydrochloride

Systemtic Name: 4-[3-(4-tert-butylcyclohexyl)-4-(4-butylpiperazin-1-yl)phenyl]thiomorpholine hydrochloride Openeye Name: 4-[3-(4-tert-butylcyclohexyl)-4-(4-butylpiperazin-1-yl)phenyl]thiomorpholine hydrochloride CAS Name: 4-[3-(4-tert-butylcyclohexyl)-4-(4-butyl-1-piperazinyl)phenyl]thiomorpholine hydrochloride IUPAC Name: 4-[3-(4-tert-butylcyclohexyl)-4-(4-butylpiperazin-1-yl)phenyl]thiomorpholine hydrochloride Traditional Name: 4-[3-(4-tert-butylcyclohexyl)-4-(4-butylpiperazino)phenyl]thiomorpholine hydrochloride Formula: C28H48ClN3S MolecularWeight: 494.21882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C=C(C=C2)N3CCSCC3)C4CCC(CC4)C(C)(C)C.Cl

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C=C(C=C2)N3CCSCC3)C4CCC(CC4)C(C)(C)C.Cl

InChI

InChI=1S/C28H47N3S.ClH/c1-5-6-13-29-14-16-31(17-15-29)27-12-11-25(30-18-20-32-21-19-30)22-26(27)23-7-9-24(10-8-23)28(2,3)4;/h11-12,22-24H,5-10,13-21H2,1-4H3;1H