1-[2,6-di(propan-2-yl)phenyl]-3-[(2-heptyl-1,3-dithiolan-2-yl)methyl]urea

Systemtic Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[(2-heptyl-1,3-dithiolan-2-yl)methyl]urea Openeye Name: 1-(2,6-diisopropylphenyl)-3-[(2-heptyl-1,3-dithiolan-2-yl)methyl]urea CAS Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[(2-heptyl-1,3-dithiolan-2-yl)methyl]urea IUPAC Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[(2-heptyl-1,3-dithiolan-2-yl)methyl]urea Traditional Name: 1-(2,6-diisopropylphenyl)-3-[(2-heptyl-1,3-dithiolan-2-yl)methyl]urea Formula: C24H40N2OS2 MolecularWeight: 436.7172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(SCCS1)CNC(=O)NC2=C(C=CC=C2C(C)C)C(C)C

Isomeric SMILES

CCCCCCCC1(SCCS1)CNC(=O)NC2=C(C=CC=C2C(C)C)C(C)C

InChI

InChI=1S/C24H40N2OS2/c1-6-7-8-9-10-14-24(28-15-16-29-24)17-25-23(27)26-22-20(18(2)3)12-11-13-21(22)19(4)5/h11-13,18-19H,6-10,14-17H2,1-5H3,(H2,25,26,27)