3-(1,3-benzothiazol-2-yl)-7-methoxy-6-propyl-chromen-4-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-7-methoxy-6-propyl-chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-7-methoxy-6-propyl-chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-7-methoxy-6-propyl-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-7-methoxy-6-propylchromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-7-methoxy-6-propyl-chromone Formula: C20H17NO3S MolecularWeight: 351.41888

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C20H17NO3S/c1-3-6-12-9-13-17(10-16(12)23-2)24-11-14(19(13)22)20-21-15-7-4-5-8-18(15)25-20/h4-5,7-11H,3,6H2,1-2H3