1-(3-methylbutyl)-3-[(4-methylsulfonylphenyl)carbonylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[(4-methylsulfonylphenyl)carbonylamino]thiourea Openeye Name: 1-isopentyl-3-[(4-methylsulfonylbenzoyl)amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[(4-methylsulfonylphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[(4-methylsulfonylbenzoyl)amino]thiourea Traditional Name: 1-isoamyl-3-[(4-mesylbenzoyl)amino]thiourea Formula: C14H21N3O3S2 MolecularWeight: 343.46484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3S2/c1-10(2)8-9-15-14(21)17-16-13(18)11-4-6-12(7-5-11)22(3,19)20/h4-7,10H,8-9H2,1-3H3,(H,16,18)(H2,15,17,21)