1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-1-butyl-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-1-butyl-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-butyl-1-[(3S)-1,1-dioxothiolan-3-yl]thiourea CAS Name: 1-butyl-1-[(3S)-1,1-dioxo-3-thiolanyl]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-butyl-1-[(3S)-1,1-dioxothiolan-3-yl]thiourea Traditional Name: 3-benzyl-1-butyl-1-[(3S)-1,1-diketothiolan-3-yl]thiourea Formula: C16H24N2O2S2 MolecularWeight: 340.50396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=S)NCC2=CC=CC=C2

Isomeric SMILES

CCCCN([C@H]1CCS(=O)(=O)C1)C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C16H24N2O2S2/c1-2-3-10-18(15-9-11-22(19,20)13-15)16(21)17-12-14-7-5-4-6-8-14/h4-8,15H,2-3,9-13H2,1H3,(H,17,21)/t15-/m0/s1