1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-(4-butylphenyl)-1-ethyl-thiourea

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-(4-butylphenyl)-1-ethyl-thiourea Openeye Name: 3-(4-butylphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]-1-ethyl-thiourea CAS Name: 3-(4-butylphenyl)-1-[(3S)-1,1-dioxo-3-thiolanyl]-1-ethylthiourea IUPAC Name: 3-(4-butylphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]-1-ethylthiourea Traditional Name: 3-(4-butylphenyl)-1-[(3S)-1,1-diketothiolan-3-yl]-1-ethyl-thiourea Formula: C17H26N2O2S2 MolecularWeight: 354.53054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N(CC)C2CCS(=O)(=O)C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(CC)[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C17H26N2O2S2/c1-3-5-6-14-7-9-15(10-8-14)18-17(22)19(4-2)16-11-12-23(20,21)13-16/h7-10,16H,3-6,11-13H2,1-2H3,(H,18,22)/t16-/m0/s1