1-butyl-3-(4-heptoxy-2-methyl-phenyl)sulfonyl-thiourea

Systemtic Name: 1-butyl-3-(4-heptoxy-2-methyl-phenyl)sulfonyl-thiourea Openeye Name: 1-butyl-3-(4-heptoxy-2-methyl-phenyl)sulfonyl-thiourea CAS Name: 1-butyl-3-(4-heptoxy-2-methylphenyl)sulfonylthiourea IUPAC Name: 1-butyl-3-(4-heptoxy-2-methylphenyl)sulfonylthiourea Traditional Name: 1-butyl-3-(4-heptoxy-2-methyl-phenyl)sulfonyl-thiourea Formula: C19H32N2O3S2 MolecularWeight: 400.59898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC(=C(C=C1)S(=O)(=O)NC(=S)NCCCC)C

Isomeric SMILES

CCCCCCCOC1=CC(=C(C=C1)S(=O)(=O)NC(=S)NCCCC)C

InChI

InChI=1S/C19H32N2O3S2/c1-4-6-8-9-10-14-24-17-11-12-18(16(3)15-17)26(22,23)21-19(25)20-13-7-5-2/h11-12,15H,4-10,13-14H2,1-3H3,(H2,20,21,25)