4-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-pyridin-3-yl-quinazoline

Systemtic Name: 4-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-pyridin-3-yl-quinazoline Openeye Name: 4-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-2-(3-pyridyl)quinazoline CAS Name: 4-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-2-(3-pyridinyl)quinazoline IUPAC Name: 4-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-pyridin-3-ylquinazoline Traditional Name: 4-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-2-(3-pyridyl)quinazoline Formula: C24H24N6S MolecularWeight: 428.55256

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)C5CCCCC5

Isomeric SMILES

C=CCN1C(=NN=C1SC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)C5CCCCC5

InChI

InChI=1S/C24H24N6S/c1-2-15-30-22(17-9-4-3-5-10-17)28-29-24(30)31-23-19-12-6-7-13-20(19)26-21(27-23)18-11-8-14-25-16-18/h2,6-8,11-14,16-17H,1,3-5,9-10,15H2