1-ethyl-1-[(E)-4-[ethyl(phenylcarbamothioyl)amino]but-2-enyl]-3-phenyl-thiourea

Systemtic Name: 1-ethyl-1-[(E)-4-[ethyl(phenylcarbamothioyl)amino]but-2-enyl]-3-phenyl-thiourea Openeye Name: 1-ethyl-1-[(E)-4-[ethyl(phenylcarbamothioyl)amino]but-2-enyl]-3-phenyl-thiourea CAS Name: 1-[(E)-4-[[anilino(sulfanylidene)methyl]-ethylamino]but-2-enyl]-1-ethyl-3-phenylthiourea IUPAC Name: 1-ethyl-1-[(E)-4-[ethyl(phenylcarbamothioyl)amino]but-2-enyl]-3-phenylthiourea Traditional Name: 1-ethyl-1-[(E)-4-[ethyl(phenylthiocarbamoyl)amino]but-2-enyl]-3-phenyl-thiourea Formula: C22H28N4S2 MolecularWeight: 412.61452

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC=CCN(CC)C(=S)NC1=CC=CC=C1)C(=S)NC2=CC=CC=C2

Isomeric SMILES

CCN(C/C=C/CN(CC)C(=S)NC1=CC=CC=C1)C(=S)NC2=CC=CC=C2

InChI

InChI=1S/C22H28N4S2/c1-3-25(21(27)23-19-13-7-5-8-14-19)17-11-12-18-26(4-2)22(28)24-20-15-9-6-10-16-20/h5-16H,3-4,17-18H2,1-2H3,(H,23,27)(H,24,28)/b12-11+