N-(1,3-benzothiazol-2-yl)-3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-6-yl)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-6-yl)propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-(7-methoxy-4-methyl-2-oxo-chromen-6-yl)propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-6-yl)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-(7-methoxy-4-methyl-2-oxochromen-6-yl)propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-(2-keto-7-methoxy-4-methyl-chromen-6-yl)propionamide Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)CCC(=O)NC3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)CCC(=O)NC3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C21H18N2O4S/c1-12-9-20(25)27-17-11-16(26-2)13(10-14(12)17)7-8-19(24)23-21-22-15-5-3-4-6-18(15)28-21/h3-6,9-11H,7-8H2,1-2H3,(H,22,23,24)