(3R,4S)-6-azanyl-2-azanylidene-4-(2,5-diethoxyphenyl)-3,4-dihydrothiopyran-3,5-dicarbonitrile

Systemtic Name: (3R,4S)-6-azanyl-2-azanylidene-4-(2,5-diethoxyphenyl)-3,4-dihydrothiopyran-3,5-dicarbonitrile Openeye Name: (3R,4S)-6-amino-4-(2,5-diethoxyphenyl)-2-imino-3,4-dihydrothiopyran-3,5-dicarbonitrile CAS Name: (3R,4S)-6-amino-4-(2,5-diethoxyphenyl)-2-imino-3,4-dihydrothiopyran-3,5-dicarbonitrile IUPAC Name: (3R,4S)-6-amino-4-(2,5-diethoxyphenyl)-2-imino-3,4-dihydrothiopyran-3,5-dicarbonitrile Traditional Name: (3R,4S)-6-amino-4-(2,5-diethoxyphenyl)-2-imino-3,4-dihydrothiopyran-3,5-dicarbonitrile Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)C2C(C(=N)SC(=C2C#N)N)C#N

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)[C@@H]2[C@@H](C(=N)SC(=C2C#N)N)C#N

InChI

InChI=1S/C17H18N4O2S/c1-3-22-10-5-6-14(23-4-2)11(7-10)15-12(8-18)16(20)24-17(21)13(15)9-19/h5-7,12,15,20H,3-4,21H2,1-2H3/t12-,15+/m0/s1