2-(cyclohexen-1-yl)-N,N-diethyl-1-(6-isothiocyanato-1H-benzimidazol-2-yl)ethanamine

Systemtic Name: 2-(cyclohexen-1-yl)-N,N-diethyl-1-(6-isothiocyanato-1H-benzimidazol-2-yl)ethanamine Openeye Name: 2-(cyclohexen-1-yl)-N,N-diethyl-1-(6-isothiocyanato-1H-benzimidazol-2-yl)ethanamine CAS Name: 2-(1-cyclohexenyl)-N,N-diethyl-1-(6-isothiocyanato-1H-benzimidazol-2-yl)ethanamine IUPAC Name: 2-(cyclohexen-1-yl)-N,N-diethyl-1-(6-isothiocyanato-1H-benzimidazol-2-yl)ethanamine Traditional Name: [2-(cyclohexen-1-yl)-1-(6-isothiocyanato-1H-benzimidazol-2-yl)ethyl]-diethyl-amine Formula: C20H26N4S MolecularWeight: 354.51224

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC1=CCCCC1)C2=NC3=C(N2)C=C(C=C3)N=C=S

Isomeric SMILES

CCN(CC)C(CC1=CCCCC1)C2=NC3=C(N2)C=C(C=C3)N=C=S

InChI

InChI=1S/C20H26N4S/c1-3-24(4-2)19(12-15-8-6-5-7-9-15)20-22-17-11-10-16(21-14-25)13-18(17)23-20/h8,10-11,13,19H,3-7,9,12H2,1-2H3,(H,22,23)