1-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoylamino]-3-(3-methylbutyl)thiourea

Systemtic Name: 1-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]amino]-3-isopentyl-thiourea CAS Name: 1-[[2-[(4-fluorophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[[2-[(4-fluorophenyl)sulfonyl-methylamino]acetyl]amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]amino]-3-isoamyl-thiourea Formula: C15H23FN4O3S2 MolecularWeight: 390.496523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C15H23FN4O3S2/c1-11(2)8-9-17-15(24)19-18-14(21)10-20(3)25(22,23)13-6-4-12(16)5-7-13/h4-7,11H,8-10H2,1-3H3,(H,18,21)(H2,17,19,24)