N-(1,3-diethyl-2-oxidanylidene-benzimidazol-5-yl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-diethyl-2-oxidanylidene-benzimidazol-5-yl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,3-diethyl-2-oxo-benzimidazol-5-yl)acetamide CAS Name: N-(1,3-diethyl-2-oxo-5-benzimidazolyl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1,3-diethyl-2-oxobenzimidazol-5-yl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(1,3-diethyl-2-keto-benzimidazol-5-yl)acetamide Formula: C23H25N7O2S MolecularWeight: 463.5553

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)CSC3=NN=C(N3CC=C)C4=CC=NC=C4)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)CSC3=NN=C(N3CC=C)C4=CC=NC=C4)N(C1=O)CC

InChI

InChI=1S/C23H25N7O2S/c1-4-13-30-21(16-9-11-24-12-10-16)26-27-22(30)33-15-20(31)25-17-7-8-18-19(14-17)29(6-3)23(32)28(18)5-2/h4,7-12,14H,1,5-6,13,15H2,2-3H3,(H,25,31)