1-(3-methylbutyl)-3-[2-[methyl-[(E)-2-phenylethenyl]sulfonyl-amino]ethanoylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[2-[methyl-[(E)-2-phenylethenyl]sulfonyl-amino]ethanoylamino]thiourea Openeye Name: 1-isopentyl-3-[[2-[methyl-[(E)-styryl]sulfonyl-amino]acetyl]amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[[2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]acetyl]amino]thiourea Traditional Name: 1-isoamyl-3-[[2-[methyl-[(E)-styryl]sulfonyl-amino]acetyl]amino]thiourea Formula: C17H26N4O3S2 MolecularWeight: 398.54334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)CN(C)S(=O)(=O)C=CC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C17H26N4O3S2/c1-14(2)9-11-18-17(25)20-19-16(22)13-21(3)26(23,24)12-10-15-7-5-4-6-8-15/h4-8,10,12,14H,9,11,13H2,1-3H3,(H,19,22)(H2,18,20,25)/b12-10+