3-ethyl-4-[(Z)-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-ethyl-4-[(Z)-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(Z)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-3-ethyl-1H-1,2,4-triazole-5-thione CAS Name: 3-ethyl-4-[(Z)-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(Z)-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)methylideneamino]-3-ethyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(Z)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-3-ethyl-1H-1,2,4-triazole-5-thione Formula: C20H19N7S MolecularWeight: 389.47676

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1N=CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=NNC(=S)N1/N=C\C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C20H19N7S/c1-2-18-23-24-20(28)27(18)22-12-17-14-26(13-15-7-4-3-5-8-15)25-19(17)16-9-6-10-21-11-16/h3-12,14H,2,13H2,1H3,(H,24,28)/b22-12-