4-[2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]ethanoylamino]benzamide Openeye Name: 4-[[2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]acetyl]amino]benzamide CAS Name: 4-[[2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]acetyl]amino]benzamide Traditional Name: 4-[[2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]acetyl]amino]benzamide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)NC3=CC=C(C=C3)C(=O)N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)NC3=CC=C(C=C3)C(=O)N)C

InChI

InChI=1S/C21H20N2O4S/c1-12-7-17-15(9-20(25)27-18(17)8-13(12)2)10-28-11-19(24)23-16-5-3-14(4-6-16)21(22)26/h3-9H,10-11H2,1-2H3,(H2,22,26)(H,23,24)