2-(2-methylfuran-3-yl)carbonyl-3,3-bis(pyridin-3-ylmethylamino)prop-2-enenitrile

Systemtic Name: 2-(2-methylfuran-3-yl)carbonyl-3,3-bis(pyridin-3-ylmethylamino)prop-2-enenitrile Openeye Name: 2-(2-methylfuran-3-carbonyl)-3,3-bis(3-pyridylmethylamino)prop-2-enenitrile CAS Name: 2-[(2-methyl-3-furanyl)-oxomethyl]-3,3-bis(3-pyridinylmethylamino)-2-propenenitrile IUPAC Name: 2-(2-methylfuran-3-carbonyl)-3,3-bis(pyridin-3-ylmethylamino)prop-2-enenitrile Traditional Name: 2-(2-methyl-3-furoyl)-3,3-bis(3-pyridylmethylamino)acrylonitrile Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)C(=C(NCC2=CN=CC=C2)NCC3=CN=CC=C3)C#N

Isomeric SMILES

CC1=C(C=CO1)C(=O)C(=C(NCC2=CN=CC=C2)NCC3=CN=CC=C3)C#N

InChI

InChI=1S/C21H19N5O2/c1-15-18(6-9-28-15)20(27)19(10-22)21(25-13-16-4-2-7-23-11-16)26-14-17-5-3-8-24-12-17/h2-9,11-12,25-26H,13-14H2,1H3