ethyl N-[4-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-2-oxidanylidene-chromen-7-yl]carbamate

Systemtic Name: ethyl N-[4-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-2-oxidanylidene-chromen-7-yl]carbamate Openeye Name: ethyl N-[4-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-2-oxo-chromen-7-yl]carbamate CAS Name: N-[4-[[(1-methyl-2-benzimidazolyl)thio]methyl]-2-oxo-1-benzopyran-7-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-2-oxochromen-7-yl]carbamate Traditional Name: N-[2-keto-4-[[(1-methylbenzimidazol-2-yl)thio]methyl]chromen-7-yl]carbamic acid ethyl ester Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4N3C

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C21H19N3O4S/c1-3-27-21(26)22-14-8-9-15-13(10-19(25)28-18(15)11-14)12-29-20-23-16-6-4-5-7-17(16)24(20)2/h4-11H,3,12H2,1-2H3,(H,22,26)