1-(2-tert-butyl-6-ethyl-phenyl)-3-(2-cyano-3-naphthalen-2-yl-3-oxidanylidene-prop-1-enyl)thiourea

Systemtic Name: 1-(2-tert-butyl-6-ethyl-phenyl)-3-(2-cyano-3-naphthalen-2-yl-3-oxidanylidene-prop-1-enyl)thiourea Openeye Name: 1-(2-tert-butyl-6-ethyl-phenyl)-3-[2-cyano-3-(2-naphthyl)-3-oxo-prop-1-enyl]thiourea CAS Name: 1-(2-tert-butyl-6-ethylphenyl)-3-[2-cyano-3-(2-naphthalenyl)-3-oxoprop-1-enyl]thiourea IUPAC Name: 1-(2-tert-butyl-6-ethylphenyl)-3-(2-cyano-3-naphthalen-2-yl-3-oxoprop-1-enyl)thiourea Traditional Name: 1-(2-tert-butyl-6-ethyl-phenyl)-3-[2-cyano-3-keto-3-(2-naphthyl)prop-1-enyl]thiourea Formula: C27H27N3OS MolecularWeight: 441.58778

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)C(C)(C)C)NC(=S)NC=C(C#N)C(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCC1=C(C(=CC=C1)C(C)(C)C)NC(=S)NC=C(C#N)C(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C27H27N3OS/c1-5-18-11-8-12-23(27(2,3)4)24(18)30-26(32)29-17-22(16-28)25(31)21-14-13-19-9-6-7-10-20(19)15-21/h6-15,17H,5H2,1-4H3,(H2,29,30,32)