1-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoylamino]-3-(3-methylbutyl)thiourea

Systemtic Name: 1-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoylamino]-3-isopentyl-thiourea CAS Name: 1-[[3-[(3,4-dimethylphenyl)sulfonylamino]-1-oxopropyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoylamino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoylamino]-3-isoamyl-thiourea Formula: C17H28N4O3S2 MolecularWeight: 400.55922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)NNC(=S)NCCC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)NNC(=S)NCCC(C)C)C

InChI

InChI=1S/C17H28N4O3S2/c1-12(2)7-9-18-17(25)21-20-16(22)8-10-19-26(23,24)15-6-5-13(3)14(4)11-15/h5-6,11-12,19H,7-10H2,1-4H3,(H,20,22)(H2,18,21,25)