methyl 2-[[2-azanylidene-7-(diethylamino)chromen-3-yl]carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2-azanylidene-7-(diethylamino)chromen-3-yl]carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[7-(diethylamino)-2-imino-chromene-3-carbonyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[[7-(diethylamino)-2-imino-1-benzopyran-3-yl]-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[7-(diethylamino)-2-iminochromene-3-carbonyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[7-(diethylamino)-2-imino-chromene-3-carbonyl]amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C=C(C(=N)O2)C(=O)NC3=C(C=C(S3)C)C(=O)OC

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C=C(C(=N)O2)C(=O)NC3=C(C=C(S3)C)C(=O)OC

InChI

InChI=1S/C21H23N3O4S/c1-5-24(6-2)14-8-7-13-10-15(18(22)28-17(13)11-14)19(25)23-20-16(21(26)27-4)9-12(3)29-20/h7-11,22H,5-6H2,1-4H3,(H,23,25)