ethyl N-[2-oxidanylidene-4-(quinazolin-4-ylsulfanylmethyl)chromen-7-yl]carbamate

Systemtic Name: ethyl N-[2-oxidanylidene-4-(quinazolin-4-ylsulfanylmethyl)chromen-7-yl]carbamate Openeye Name: ethyl N-[2-oxo-4-(quinazolin-4-ylsulfanylmethyl)chromen-7-yl]carbamate CAS Name: N-[2-oxo-4-[(4-quinazolinylthio)methyl]-1-benzopyran-7-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-oxo-4-(quinazolin-4-ylsulfanylmethyl)chromen-7-yl]carbamate Traditional Name: N-[2-keto-4-[(quinazolin-4-ylthio)methyl]chromen-7-yl]carbamic acid ethyl ester Formula: C21H17N3O4S MolecularWeight: 407.44238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C21H17N3O4S/c1-2-27-21(26)24-14-7-8-15-13(9-19(25)28-18(15)10-14)11-29-20-16-5-3-4-6-17(16)22-12-23-20/h3-10,12H,2,11H2,1H3,(H,24,26)