4-(cyclopropylcarbonylamino)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]benzenecarboximidate

Systemtic Name: 4-(cyclopropylcarbonylamino)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]benzenecarboximidate Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-(cyclopropanecarbonylamino)benzenecarboximidate CAS Name: 4-[[cyclopropyl(oxo)methyl]amino]-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]benzenecarboximidate IUPAC Name: 4-(cyclopropanecarbonylamino)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]benzenecarboximidate Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-(cyclopropanecarbonylamino)benzenecarboximidate Formula: C20H19N6O2S2- MolecularWeight: 439.53386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N=C(C2=CC=C(C=C2)NC(=O)C3CC3)[O-])C4=NNC(=S)N4CC=C

Isomeric SMILES

CC1=C(SC(=N1)N=C(C2=CC=C(C=C2)NC(=O)C3CC3)[O-])C4=NNC(=S)N4CC=C

InChI

InChI=1S/C20H20N6O2S2/c1-3-10-26-16(24-25-20(26)29)15-11(2)21-19(30-15)23-18(28)13-6-8-14(9-7-13)22-17(27)12-4-5-12/h3,6-9,12H,1,4-5,10H2,2H3,(H,22,27)(H,25,29)(H,21,23,28)/p-1