N-[5-(4-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-4-methyl-1,3-thiazol-2-yl]-4-hexoxy-3-methoxy-benzenecarboximidate

Systemtic Name: N-[5-(4-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-4-methyl-1,3-thiazol-2-yl]-4-hexoxy-3-methoxy-benzenecarboximidate Openeye Name: N-[5-(4-cyclopropyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-hexoxy-3-methoxy-benzenecarboximidate CAS Name: N-[5-(4-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-4-methyl-2-thiazolyl]-4-hexoxy-3-methoxybenzenecarboximidate IUPAC Name: N-[5-(4-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-4-methyl-1,3-thiazol-2-yl]-4-hexoxy-3-methoxybenzenecarboximidate Traditional Name: N-[5-(4-cyclopropyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-hexoxy-3-methoxy-benzenecarboximidate Formula: C23H28N5O3S2- MolecularWeight: 486.63012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=NC2=NC(=C(S2)C3=NNC(=S)N3C4CC4)C)[O-])OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=NC2=NC(=C(S2)C3=NNC(=S)N3C4CC4)C)[O-])OC

InChI

InChI=1S/C23H29N5O3S2/c1-4-5-6-7-12-31-17-11-8-15(13-18(17)30-3)21(29)25-22-24-14(2)19(33-22)20-26-27-23(32)28(20)16-9-10-16/h8,11,13,16H,4-7,9-10,12H2,1-3H3,(H,27,32)(H,24,25,29)/p-1