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

Systemtic Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-4-(phenylcarbamoylamino)benzamide Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-(phenylcarbamoylamino)benzamide CAS Name: 4-[[anilino(oxo)methyl]amino]-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]benzamide IUPAC Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-4-(phenylcarbamoylamino)benzamide Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-(phenylcarbamoylamino)benzamide Formula: C23H21N7O2S2 MolecularWeight: 491.58854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3)C4=NNC(=S)N4CC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3)C4=NNC(=S)N4CC=C

InChI

InChI=1S/C23H21N7O2S2/c1-3-13-30-19(28-29-23(30)33)18-14(2)24-22(34-18)27-20(31)15-9-11-17(12-10-15)26-21(32)25-16-7-5-4-6-8-16/h3-12H,1,13H2,2H3,(H,29,33)(H,24,27,31)(H2,25,26,32)