3-(aminocarbonylamino)-3-(3-methylphenyl)-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]propanamide

Systemtic Name: 3-(aminocarbonylamino)-3-(3-methylphenyl)-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]propanamide Openeye Name: N-[(5-morpholinosulfonyl-2-thienyl)methyl]-3-(m-tolyl)-3-ureido-propanamide CAS Name: 3-(carbamoylamino)-3-(3-methylphenyl)-N-[[5-(4-morpholinylsulfonyl)-2-thiophenyl]methyl]propanamide IUPAC Name: 3-(carbamoylamino)-3-(3-methylphenyl)-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]propanamide Traditional Name: N-[(5-morpholinosulfonyl-2-thienyl)methyl]-3-(m-tolyl)-3-ureido-propionamide Formula: C20H26N4O5S2 MolecularWeight: 466.57424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3)NC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)C(CC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3)NC(=O)N

InChI

InChI=1S/C20H26N4O5S2/c1-14-3-2-4-15(11-14)17(23-20(21)26)12-18(25)22-13-16-5-6-19(30-16)31(27,28)24-7-9-29-10-8-24/h2-6,11,17H,7-10,12-13H2,1H3,(H,22,25)(H3,21,23,26)