1-[2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]ethanoylamino]-3-phenethyl-thiourea

Systemtic Name: 1-[2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]ethanoylamino]-3-phenethyl-thiourea Openeye Name: 1-[[2-[(3S)-1,1-dioxothiolan-3-yl]acetyl]amino]-3-phenethyl-thiourea CAS Name: 1-[[2-[(3S)-1,1-dioxo-3-thiolanyl]-1-oxoethyl]amino]-3-phenethylthiourea IUPAC Name: 1-[[2-[(3S)-1,1-dioxothiolan-3-yl]acetyl]amino]-3-phenethylthiourea Traditional Name: 1-[[2-[(3S)-1,1-diketothiolan-3-yl]acetyl]amino]-3-phenethyl-thiourea Formula: C15H21N3O3S2 MolecularWeight: 355.47554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1CC(=O)NNC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1CC(=O)NNC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C15H21N3O3S2/c19-14(10-13-7-9-23(20,21)11-13)17-18-15(22)16-8-6-12-4-2-1-3-5-12/h1-5,13H,6-11H2,(H,17,19)(H2,16,18,22)/t13-/m1/s1