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

Systemtic Name: 7-ethyl-4-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-ethyl-4-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-ethyl-4-[[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-ethyl-4-[[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C18H21N3O2S2 MolecularWeight: 375.50824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(S3)NCC(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(S3)NCC(C)C

InChI

InChI=1S/C18H21N3O2S2/c1-4-12-5-6-14-13(8-16(22)23-15(14)7-12)10-24-18-21-20-17(25-18)19-9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,19,20)