1-[2-[8-(phenylcarbonyl)-3H-benzo[f]thiochromen-10-yl]ethyl]-3-propyl-urea

Systemtic Name: 1-[2-[8-(phenylcarbonyl)-3H-benzo[f]thiochromen-10-yl]ethyl]-3-propyl-urea Openeye Name: 1-[2-(8-benzoyl-3H-benzo[f]thiochromen-10-yl)ethyl]-3-propyl-urea CAS Name: 1-[2-(8-benzoyl-3H-benzo[f]thiochromen-10-yl)ethyl]-3-propylurea IUPAC Name: 1-[2-(8-benzoyl-3H-benzo[f]thiochromen-10-yl)ethyl]-3-propylurea Traditional Name: 1-[2-(8-benzoyl-3H-benzo[f]thiochromen-10-yl)ethyl]-3-propyl-urea Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NCCC1=C2C(=CC(=C1)C(=O)C3=CC=CC=C3)C=CC4=C2C=CCS4

Isomeric SMILES

CCCNC(=O)NCCC1=C2C(=CC(=C1)C(=O)C3=CC=CC=C3)C=CC4=C2C=CCS4

InChI

InChI=1S/C26H26N2O2S/c1-2-13-27-26(30)28-14-12-20-17-21(25(29)18-7-4-3-5-8-18)16-19-10-11-23-22(24(19)20)9-6-15-31-23/h3-11,16-17H,2,12-15H2,1H3,(H2,27,28,30)