methyl 3-(cyclopropylcarbonylamino)-2-(2,3-dihydro-1H-benzo[f]thiochromen-10-yl)propanoate

Systemtic Name: methyl 3-(cyclopropylcarbonylamino)-2-(2,3-dihydro-1H-benzo[f]thiochromen-10-yl)propanoate Openeye Name: methyl 3-(cyclopropanecarbonylamino)-2-(2,3-dihydro-1H-benzo[f]thiochromen-10-yl)propanoate CAS Name: 3-[[cyclopropyl(oxo)methyl]amino]-2-(2,3-dihydro-1H-benzo[f]thiochromen-10-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(cyclopropanecarbonylamino)-2-(2,3-dihydro-1H-benzo[f]thiochromen-10-yl)propanoate Traditional Name: 3-(cyclopropanecarbonylamino)-2-(2,3-dihydro-1H-benzo[f]thiochromen-10-yl)propionic acid methyl ester Formula: C21H23NO3S MolecularWeight: 369.47722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CNC(=O)C1CC1)C2=CC=CC3=C2C4=C(C=C3)SCCC4

Isomeric SMILES

COC(=O)C(CNC(=O)C1CC1)C2=CC=CC3=C2C4=C(C=C3)SCCC4

InChI

InChI=1S/C21H23NO3S/c1-25-21(24)17(12-22-20(23)14-7-8-14)15-5-2-4-13-9-10-18-16(19(13)15)6-3-11-26-18/h2,4-5,9-10,14,17H,3,6-8,11-12H2,1H3,(H,22,23)