[2,4-bis(2-methylbutan-2-yl)phenyl] (Z)-3-phenylazanyl-2-thiophen-2-ylcarbonyl-prop-2-enoate

Systemtic Name: [2,4-bis(2-methylbutan-2-yl)phenyl] (Z)-3-phenylazanyl-2-thiophen-2-ylcarbonyl-prop-2-enoate Openeye Name: [2,4-bis(1,1-dimethylpropyl)phenyl] (Z)-3-anilino-2-(thiophene-2-carbonyl)prop-2-enoate CAS Name: (Z)-3-anilino-2-[oxo(thiophen-2-yl)methyl]-2-propenoic acid [2,4-bis(2-methylbutan-2-yl)phenyl] ester IUPAC Name: [2,4-bis(2-methylbutan-2-yl)phenyl] (Z)-3-anilino-2-(thiophene-2-carbonyl)prop-2-enoate Traditional Name: (Z)-3-anilino-2-(2-thenoyl)acrylic acid (2,4-ditert-amylphenyl) ester Formula: C30H35NO3S MolecularWeight: 489.6688

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OC(=O)C(=CNC2=CC=CC=C2)C(=O)C3=CC=CS3)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OC(=O)/C(=C\NC2=CC=CC=C2)/C(=O)C3=CC=CS3)C(C)(C)CC

InChI

InChI=1S/C30H35NO3S/c1-7-29(3,4)21-16-17-25(24(19-21)30(5,6)8-2)34-28(33)23(27(32)26-15-12-18-35-26)20-31-22-13-10-9-11-14-22/h9-20,31H,7-8H2,1-6H3/b23-20-