ethyl (1E)-N-(3-cyano-9-methoxy-4-thiophen-2-yl-5,6-dihydro-4H-benzo[h]chromen-2-yl)methanimidate

Systemtic Name: ethyl (1E)-N-(3-cyano-9-methoxy-4-thiophen-2-yl-5,6-dihydro-4H-benzo[h]chromen-2-yl)methanimidate Openeye Name: ethyl (1E)-N-[3-cyano-9-methoxy-4-(2-thienyl)-5,6-dihydro-4H-benzo[h]chromen-2-yl]methanimidate CAS Name: (1E)-N-(3-cyano-9-methoxy-4-thiophen-2-yl-5,6-dihydro-4H-benzo[h][1]benzopyran-2-yl)methanimidic acid ethyl ester IUPAC Name: ethyl (1E)-N-(3-cyano-9-methoxy-4-thiophen-2-yl-5,6-dihydro-4H-benzo[h]chromen-2-yl)methanimidate Traditional Name: (1E)-N-[3-cyano-9-methoxy-4-(2-thienyl)-5,6-dihydro-4H-benzo[h]chromen-2-yl]formimidic acid ethyl ester Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=NC1=C(C(C2=C(O1)C3=C(CC2)C=CC(=C3)OC)C4=CC=CS4)C#N

Isomeric SMILES

CCO/C=N/C1=C(C(C2=C(O1)C3=C(CC2)C=CC(=C3)OC)C4=CC=CS4)C#N

InChI

InChI=1S/C22H20N2O3S/c1-3-26-13-24-22-18(12-23)20(19-5-4-10-28-19)16-9-7-14-6-8-15(25-2)11-17(14)21(16)27-22/h4-6,8,10-11,13,20H,3,7,9H2,1-2H3/b24-13+