methyl 2-[(3-azanylidenebenzo[f]chromen-2-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-azanylidenebenzo[f]chromen-2-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(3-iminobenzo[f]chromene-2-carbonyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(3-imino-2-benzo[f][1]benzopyranyl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-iminobenzo[f]chromene-2-carbonyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(3-iminobenzo[f]chromene-2-carbonyl)amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H16N2O4S MolecularWeight: 392.42774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=CC3=C(C=CC4=CC=CC=C43)OC2=N)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=CC3=C(C=CC4=CC=CC=C43)OC2=N)C(=O)OC

InChI

InChI=1S/C21H16N2O4S/c1-11-9-16(21(25)26-2)20(28-11)23-19(24)15-10-14-13-6-4-3-5-12(13)7-8-17(14)27-18(15)22/h3-10,22H,1-2H3,(H,23,24)