6-[[5-(2,4-dichlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile

Systemtic Name: 6-[[5-(2,4-dichlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Openeye Name: 6-[[4-allyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile CAS Name: 6-[[5-(2,4-dichlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-3-pyridinecarbonitrile IUPAC Name: 6-[[5-(2,4-dichlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Traditional Name: 6-[[4-allyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]thio]nicotinonitrile Formula: C17H11Cl2N5S MolecularWeight: 388.27374

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SC2=NC=C(C=C2)C#N)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C=CCN1C(=NN=C1SC2=NC=C(C=C2)C#N)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H11Cl2N5S/c1-2-7-24-16(13-5-4-12(18)8-14(13)19)22-23-17(24)25-15-6-3-11(9-20)10-21-15/h2-6,8,10H,1,7H2