methyl 2-azanyl-5-oxidanylidene-7-phenyl-4-thiophen-3-yl-4,6,7,8-tetrahydrochromene-3-carboxylate

Systemtic Name: methyl 2-azanyl-5-oxidanylidene-7-phenyl-4-thiophen-3-yl-4,6,7,8-tetrahydrochromene-3-carboxylate Openeye Name: methyl 2-amino-5-oxo-7-phenyl-4-(3-thienyl)-4,6,7,8-tetrahydrochromene-3-carboxylate CAS Name: 2-amino-5-oxo-7-phenyl-4-(3-thiophenyl)-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-5-oxo-7-phenyl-4-thiophen-3-yl-4,6,7,8-tetrahydrochromene-3-carboxylate Traditional Name: 2-amino-5-keto-7-phenyl-4-(3-thienyl)-4,6,7,8-tetrahydrochromene-3-carboxylic acid methyl ester Formula: C21H19NO4S MolecularWeight: 381.44486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC2=C(C1C3=CSC=C3)C(=O)CC(C2)C4=CC=CC=C4)N

Isomeric SMILES

COC(=O)C1=C(OC2=C(C1C3=CSC=C3)C(=O)CC(C2)C4=CC=CC=C4)N

InChI

InChI=1S/C21H19NO4S/c1-25-21(24)19-17(13-7-8-27-11-13)18-15(23)9-14(10-16(18)26-20(19)22)12-5-3-2-4-6-12/h2-8,11,14,17H,9-10,22H2,1H3