1-butan-2-yl-4-(4-isothiocyanatophenyl)piperazine

Systemtic Name: 1-butan-2-yl-4-(4-isothiocyanatophenyl)piperazine Openeye Name: 1-(4-isothiocyanatophenyl)-4-sec-butyl-piperazine CAS Name: 1-butan-2-yl-4-(4-isothiocyanatophenyl)piperazine IUPAC Name: 1-butan-2-yl-4-(4-isothiocyanatophenyl)piperazine Traditional Name: 1-(4-isothiocyanatophenyl)-4-sec-butyl-piperazine Formula: C15H21N3S MolecularWeight: 275.41234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCN(CC1)C2=CC=C(C=C2)N=C=S

Isomeric SMILES

CCC(C)N1CCN(CC1)C2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C15H21N3S/c1-3-13(2)17-8-10-18(11-9-17)15-6-4-14(5-7-15)16-12-19/h4-7,13H,3,8-11H2,1-2H3