1-ethyl-3-[3-(phenylsulfonyl)propanoylamino]thiourea

Systemtic Name: 1-ethyl-3-[3-(phenylsulfonyl)propanoylamino]thiourea Openeye Name: 1-[3-(benzenesulfonyl)propanoylamino]-3-ethyl-thiourea CAS Name: 1-[[3-(benzenesulfonyl)-1-oxopropyl]amino]-3-ethylthiourea IUPAC Name: 1-[3-(benzenesulfonyl)propanoylamino]-3-ethylthiourea Traditional Name: 1-(3-besylpropanoylamino)-3-ethyl-thiourea Formula: C12H17N3O3S2 MolecularWeight: 315.41168

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)CCS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCNC(=S)NNC(=O)CCS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H17N3O3S2/c1-2-13-12(19)15-14-11(16)8-9-20(17,18)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,14,16)(H2,13,15,19)