methyl 2-[(2-azanylidene-6-bromanyl-chromen-3-yl)carbonylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-azanylidene-6-bromanyl-chromen-3-yl)carbonylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: methyl 2-[(6-bromo-2-imino-chromene-3-carbonyl)amino]-5-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[(6-bromo-2-imino-1-benzopyran-3-yl)-oxomethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(6-bromo-2-iminochromene-3-carbonyl)amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[(6-bromo-2-imino-chromene-3-carbonyl)amino]-5-isopropyl-thiophene-3-carboxylic acid methyl ester Formula: C19H17BrN2O4S MolecularWeight: 449.31828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(S1)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=N)C(=O)OC

Isomeric SMILES

CC(C)C1=CC(=C(S1)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=N)C(=O)OC

InChI

InChI=1S/C19H17BrN2O4S/c1-9(2)15-8-13(19(24)25-3)18(27-15)22-17(23)12-7-10-6-11(20)4-5-14(10)26-16(12)21/h4-9,21H,1-3H3,(H,22,23)