2,6-bis(azanyl)-4-(3-methoxy-4-phenylmethoxy-phenyl)-4H-thiopyran-3,5-dicarbonitrile

Systemtic Name: 2,6-bis(azanyl)-4-(3-methoxy-4-phenylmethoxy-phenyl)-4H-thiopyran-3,5-dicarbonitrile Openeye Name: 2,6-diamino-4-(4-benzyloxy-3-methoxy-phenyl)-4H-thiopyran-3,5-dicarbonitrile CAS Name: 2,6-diamino-4-(3-methoxy-4-phenylmethoxyphenyl)-4H-thiopyran-3,5-dicarbonitrile IUPAC Name: 2,6-diamino-4-(3-methoxy-4-phenylmethoxyphenyl)-4H-thiopyran-3,5-dicarbonitrile Traditional Name: 2,6-diamino-4-(4-benzoxy-3-methoxy-phenyl)-4H-thiopyran-3,5-dicarbonitrile Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(=C(SC(=C2C#N)N)N)C#N)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(=C(SC(=C2C#N)N)N)C#N)OCC3=CC=CC=C3

InChI

InChI=1S/C21H18N4O2S/c1-26-18-9-14(7-8-17(18)27-12-13-5-3-2-4-6-13)19-15(10-22)20(24)28-21(25)16(19)11-23/h2-9,19H,12,24-25H2,1H3