7-methoxy-4-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 7-methoxy-4-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-methoxy-4-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-methoxy-4-[[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-methoxy-4-[[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C16H17N3O3S2 MolecularWeight: 363.45448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NN=C(S1)SCC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CCCNC1=NN=C(S1)SCC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C16H17N3O3S2/c1-3-6-17-15-18-19-16(24-15)23-9-10-7-14(20)22-13-8-11(21-2)4-5-12(10)13/h4-5,7-8H,3,6,9H2,1-2H3,(H,17,18)